USER MOD reduce.3.24.130724 H: found=0, std=0, add=731, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 732 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 105 SER OG : rot 60:sc= 0.864 USER MOD Set 1.2: A 111 SER OG : rot 118:sc= 0.635 USER MOD Set 2.1: A 93 TYR OH : rot -144:sc= 0.547 USER MOD Set 2.2: A 127 LYS NZ :NH3+ 172:sc= 1.51 (180deg=0.928) USER MOD Set 2.3: A 150 HIS : no HE2:sc= -1.54 K(o=0.51,f=-1.6) USER MOD Set 3.1: A 90 TYR OH : rot 180:sc= -0.0806 USER MOD Set 3.2: A 115 HIS : no HE2:sc= -1.09 X(o=-1.2,f=-1.4) USER MOD Single : A 67 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0918) USER MOD Single : A 68 SER OG : rot 180:sc= -0.463 USER MOD Single : A 70 THR OG1 : rot 80:sc= 1.09 USER MOD Single : A 72 THR OG1 : rot -136:sc= 0.0329 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0.068 USER MOD Single : A 87 SER OG : rot 180:sc= -0.881 USER MOD Single : A 95 LYS NZ :NH3+ -162:sc= 1.59 (180deg=1.34) USER MOD Single : A 96 SER OG : rot 80:sc= 0.389 USER MOD Single : A 100 GLN : amide:sc= 0.113 X(o=0.11,f=0) USER MOD Single : A 107 ASN : amide:sc= -1.47! K(o=-1.5!,f=-0.57) USER MOD Single : A 113 SER OG : rot 108:sc= 1.26 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 79:sc= 1.3 USER MOD Single : A 123 CYS SG : rot 172:sc= -6.41! USER MOD Single : A 125 SER OG : rot 180:sc= -0.49 USER MOD Single : A 136 LYS NZ :NH3+ -169:sc= -0.0221 (180deg=-0.163) USER MOD Single : A 140 THR OG1 : rot 90:sc= 1.23 USER MOD Single : A 141 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 THR OG1 : rot -174:sc= 0.0872 USER MOD Single : A 156 LYS NZ :NH3+ -155:sc= 1.22 (180deg=0.845) USER MOD Single : A 161 ASN : amide:sc= -0.454! C(o=-0.45!,f=-7.1!) USER MOD ----------------------------------------------------------------- ATOM 67 N LYS A 67 -4.438 4.249 -13.963 1.00 0.00 N ATOM 68 CA LYS A 67 -3.212 4.168 -14.750 1.00 0.00 C ATOM 69 C LYS A 67 -1.943 4.585 -14.022 1.00 0.00 C ATOM 70 O LYS A 67 -1.026 3.792 -13.895 1.00 0.00 O ATOM 71 CB LYS A 67 -3.375 4.932 -16.070 1.00 0.00 C ATOM 72 CG LYS A 67 -4.515 4.407 -16.945 1.00 0.00 C ATOM 73 CD LYS A 67 -4.277 2.964 -17.395 1.00 0.00 C ATOM 74 CE LYS A 67 -5.472 2.410 -18.158 1.00 0.00 C ATOM 75 NZ LYS A 67 -5.786 3.195 -19.366 1.00 0.00 N ATOM 0 HA LYS A 67 -3.068 3.107 -14.952 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -3.552 5.985 -15.851 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -2.442 4.875 -16.631 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.452 4.464 -16.391 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -4.623 5.046 -17.821 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -3.390 2.921 -18.027 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -4.079 2.339 -16.524 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -5.270 1.377 -18.442 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -6.342 2.395 -17.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -6.516 2.703 -19.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -6.136 4.134 -19.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -4.927 3.303 -19.943 1.00 0.00 H new ATOM 89 N SER A 68 -1.869 5.804 -13.569 1.00 0.00 N ATOM 90 CA SER A 68 -0.676 6.255 -12.939 1.00 0.00 C ATOM 91 C SER A 68 -0.980 7.301 -11.889 1.00 0.00 C ATOM 92 O SER A 68 -2.105 7.825 -11.829 1.00 0.00 O ATOM 93 CB SER A 68 0.249 6.820 -14.012 1.00 0.00 C ATOM 94 OG SER A 68 -0.420 7.808 -14.793 1.00 0.00 O ATOM 0 H SER A 68 -2.618 6.494 -13.626 1.00 0.00 H new ATOM 0 HA SER A 68 -0.191 5.421 -12.432 1.00 0.00 H new ATOM 0 HB2 SER A 68 1.131 7.257 -13.544 1.00 0.00 H new ATOM 0 HB3 SER A 68 0.597 6.014 -14.658 1.00 0.00 H new ATOM 0 HG SER A 68 0.193 8.157 -15.473 1.00 0.00 H new ATOM 100 N LEU A 69 0.030 7.643 -11.106 1.00 0.00 N ATOM 101 CA LEU A 69 -0.065 8.663 -10.079 1.00 0.00 C ATOM 102 C LEU A 69 -0.156 10.016 -10.700 1.00 0.00 C ATOM 103 O LEU A 69 -0.667 10.960 -10.094 1.00 0.00 O ATOM 104 CB LEU A 69 1.120 8.595 -9.141 1.00 0.00 C ATOM 105 CG LEU A 69 0.985 7.611 -8.023 1.00 0.00 C ATOM 106 CD1 LEU A 69 2.306 7.412 -7.321 1.00 0.00 C ATOM 107 CD2 LEU A 69 -0.014 8.148 -7.053 1.00 0.00 C ATOM 0 H LEU A 69 0.952 7.212 -11.168 1.00 0.00 H new ATOM 0 HA LEU A 69 -0.970 8.480 -9.500 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.009 8.345 -9.720 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.285 9.585 -8.716 1.00 0.00 H new ATOM 0 HG LEU A 69 0.663 6.649 -8.422 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.183 6.692 -6.512 1.00 0.00 H new ATOM 0 HD12 LEU A 69 3.043 7.037 -8.031 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.648 8.363 -6.912 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.131 7.448 -6.226 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.331 9.108 -6.669 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.973 8.281 -7.554 1.00 0.00 H new ATOM 119 N THR A 70 0.333 10.096 -11.909 1.00 0.00 N ATOM 120 CA THR A 70 0.236 11.279 -12.717 1.00 0.00 C ATOM 121 C THR A 70 -1.270 11.568 -13.010 1.00 0.00 C ATOM 122 O THR A 70 -1.680 12.705 -13.222 1.00 0.00 O ATOM 123 CB THR A 70 0.981 11.041 -14.050 1.00 0.00 C ATOM 124 OG1 THR A 70 2.304 10.487 -13.792 1.00 0.00 O ATOM 125 CG2 THR A 70 1.133 12.342 -14.824 1.00 0.00 C ATOM 0 H THR A 70 0.819 9.325 -12.367 1.00 0.00 H new ATOM 0 HA THR A 70 0.680 12.127 -12.196 1.00 0.00 H new ATOM 0 HB THR A 70 0.394 10.339 -14.642 1.00 0.00 H new ATOM 0 HG1 THR A 70 2.227 9.527 -13.610 1.00 0.00 H new ATOM 0 HG21 THR A 70 1.660 12.150 -15.758 1.00 0.00 H new ATOM 0 HG22 THR A 70 0.147 12.753 -15.041 1.00 0.00 H new ATOM 0 HG23 THR A 70 1.701 13.056 -14.227 1.00 0.00 H new ATOM 133 N GLU A 71 -2.075 10.509 -12.970 1.00 0.00 N ATOM 134 CA GLU A 71 -3.506 10.582 -13.234 1.00 0.00 C ATOM 135 C GLU A 71 -4.313 10.532 -11.927 1.00 0.00 C ATOM 136 O GLU A 71 -5.545 10.418 -11.948 1.00 0.00 O ATOM 137 CB GLU A 71 -3.933 9.392 -14.094 1.00 0.00 C ATOM 138 CG GLU A 71 -3.295 9.319 -15.468 1.00 0.00 C ATOM 139 CD GLU A 71 -3.571 10.535 -16.307 1.00 0.00 C ATOM 140 OE1 GLU A 71 -4.748 10.955 -16.401 1.00 0.00 O ATOM 141 OE2 GLU A 71 -2.625 11.063 -16.931 1.00 0.00 O ATOM 0 H GLU A 71 -1.747 9.568 -12.751 1.00 0.00 H new ATOM 0 HA GLU A 71 -3.701 11.524 -13.747 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -3.700 8.474 -13.555 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -5.016 9.424 -14.216 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -2.218 9.198 -15.357 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -3.663 8.434 -15.987 1.00 0.00 H new ATOM 148 N THR A 72 -3.645 10.599 -10.811 1.00 0.00 N ATOM 149 CA THR A 72 -4.310 10.470 -9.549 1.00 0.00 C ATOM 150 C THR A 72 -4.468 11.846 -8.871 1.00 0.00 C ATOM 151 O THR A 72 -3.562 12.685 -8.946 1.00 0.00 O ATOM 152 CB THR A 72 -3.507 9.527 -8.652 1.00 0.00 C ATOM 153 OG1 THR A 72 -3.220 8.330 -9.373 1.00 0.00 O ATOM 154 CG2 THR A 72 -4.293 9.167 -7.429 1.00 0.00 C ATOM 0 H THR A 72 -2.637 10.743 -10.751 1.00 0.00 H new ATOM 0 HA THR A 72 -5.306 10.059 -9.712 1.00 0.00 H new ATOM 0 HB THR A 72 -2.587 10.029 -8.353 1.00 0.00 H new ATOM 0 HG1 THR A 72 -3.375 7.554 -8.794 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.705 8.495 -6.803 1.00 0.00 H new ATOM 0 HG22 THR A 72 -4.529 10.072 -6.869 1.00 0.00 H new ATOM 0 HG23 THR A 72 -5.218 8.671 -7.724 1.00 0.00 H new ATOM 162 N GLU A 73 -5.617 12.071 -8.226 1.00 0.00 N ATOM 163 CA GLU A 73 -5.879 13.336 -7.560 1.00 0.00 C ATOM 164 C GLU A 73 -5.131 13.423 -6.228 1.00 0.00 C ATOM 165 O GLU A 73 -4.887 12.395 -5.560 1.00 0.00 O ATOM 166 CB GLU A 73 -7.377 13.574 -7.362 1.00 0.00 C ATOM 167 CG GLU A 73 -8.072 12.571 -6.464 1.00 0.00 C ATOM 168 CD GLU A 73 -9.497 12.952 -6.218 1.00 0.00 C ATOM 169 OE1 GLU A 73 -9.745 13.900 -5.445 1.00 0.00 O ATOM 170 OE2 GLU A 73 -10.411 12.332 -6.810 1.00 0.00 O ATOM 0 H GLU A 73 -6.374 11.391 -8.155 1.00 0.00 H new ATOM 0 HA GLU A 73 -5.506 14.127 -8.211 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -7.519 14.571 -6.946 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -7.863 13.564 -8.337 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -8.032 11.582 -6.921 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -7.543 12.504 -5.513 1.00 0.00 H new ATOM 177 N LEU A 74 -4.808 14.639 -5.841 1.00 0.00 N ATOM 178 CA LEU A 74 -3.981 14.907 -4.688 1.00 0.00 C ATOM 179 C LEU A 74 -4.846 15.463 -3.550 1.00 0.00 C ATOM 180 O LEU A 74 -5.695 16.325 -3.769 1.00 0.00 O ATOM 181 CB LEU A 74 -2.876 15.920 -5.131 1.00 0.00 C ATOM 182 CG LEU A 74 -1.681 16.235 -4.187 1.00 0.00 C ATOM 183 CD1 LEU A 74 -2.094 16.998 -2.945 1.00 0.00 C ATOM 184 CD2 LEU A 74 -0.940 14.968 -3.818 1.00 0.00 C ATOM 0 H LEU A 74 -5.118 15.480 -6.327 1.00 0.00 H new ATOM 0 HA LEU A 74 -3.508 13.999 -4.314 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -2.459 15.554 -6.069 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.373 16.865 -5.350 1.00 0.00 H new ATOM 0 HG LEU A 74 -1.009 16.888 -4.743 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.217 17.188 -2.326 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -2.546 17.947 -3.234 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -2.816 16.409 -2.380 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -0.108 15.212 -3.157 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -1.619 14.284 -3.309 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.558 14.494 -4.722 1.00 0.00 H new ATOM 196 N LEU A 75 -4.660 14.931 -2.368 1.00 0.00 N ATOM 197 CA LEU A 75 -5.333 15.394 -1.173 1.00 0.00 C ATOM 198 C LEU A 75 -4.297 15.826 -0.138 1.00 0.00 C ATOM 199 O LEU A 75 -3.295 15.128 0.074 1.00 0.00 O ATOM 200 CB LEU A 75 -6.233 14.296 -0.538 1.00 0.00 C ATOM 201 CG LEU A 75 -7.574 13.942 -1.219 1.00 0.00 C ATOM 202 CD1 LEU A 75 -8.465 15.163 -1.343 1.00 0.00 C ATOM 203 CD2 LEU A 75 -7.378 13.260 -2.565 1.00 0.00 C ATOM 0 H LEU A 75 -4.026 14.150 -2.203 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.968 16.230 -1.466 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -5.643 13.381 -0.477 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -6.454 14.602 0.485 1.00 0.00 H new ATOM 0 HG LEU A 75 -8.077 13.222 -0.573 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -9.401 14.883 -1.826 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -8.674 15.563 -0.351 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -7.961 15.922 -1.941 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -8.350 13.032 -3.002 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -6.827 13.923 -3.232 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.817 12.336 -2.426 1.00 0.00 H new ATOM 215 N PRO A 76 -4.464 17.001 0.465 1.00 0.00 N ATOM 216 CA PRO A 76 -3.628 17.431 1.587 1.00 0.00 C ATOM 217 C PRO A 76 -3.967 16.591 2.831 1.00 0.00 C ATOM 218 O PRO A 76 -5.139 16.336 3.104 1.00 0.00 O ATOM 219 CB PRO A 76 -4.046 18.898 1.801 1.00 0.00 C ATOM 220 CG PRO A 76 -4.776 19.275 0.560 1.00 0.00 C ATOM 221 CD PRO A 76 -5.442 18.028 0.093 1.00 0.00 C ATOM 0 HA PRO A 76 -2.559 17.318 1.405 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -4.682 19.003 2.680 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -3.177 19.537 1.958 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -5.507 20.059 0.758 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -4.092 19.660 -0.196 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -6.404 17.872 0.582 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -5.629 18.043 -0.981 1.00 0.00 H new ATOM 229 N ILE A 77 -2.963 16.189 3.606 1.00 0.00 N ATOM 230 CA ILE A 77 -3.212 15.288 4.746 1.00 0.00 C ATOM 231 C ILE A 77 -3.869 16.005 5.933 1.00 0.00 C ATOM 232 O ILE A 77 -4.256 15.369 6.923 1.00 0.00 O ATOM 233 CB ILE A 77 -1.940 14.500 5.238 1.00 0.00 C ATOM 234 CG1 ILE A 77 -0.940 15.372 6.061 1.00 0.00 C ATOM 235 CG2 ILE A 77 -1.231 13.833 4.063 1.00 0.00 C ATOM 236 CD1 ILE A 77 -0.280 16.508 5.316 1.00 0.00 C ATOM 0 H ILE A 77 -1.988 16.461 3.477 1.00 0.00 H new ATOM 0 HA ILE A 77 -3.910 14.552 4.348 1.00 0.00 H new ATOM 0 HB ILE A 77 -2.306 13.734 5.922 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.471 15.786 6.918 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.160 14.720 6.454 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.355 13.294 4.425 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.912 13.134 3.576 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.919 14.593 3.347 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.392 17.042 5.988 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.288 16.110 4.475 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.043 17.193 4.946 1.00 0.00 H new ATOM 248 N THR A 78 -3.987 17.322 5.841 1.00 0.00 N ATOM 249 CA THR A 78 -4.628 18.083 6.882 1.00 0.00 C ATOM 250 C THR A 78 -6.140 17.783 6.890 1.00 0.00 C ATOM 251 O THR A 78 -6.773 17.733 7.945 1.00 0.00 O ATOM 252 CB THR A 78 -4.349 19.624 6.748 1.00 0.00 C ATOM 253 OG1 THR A 78 -4.841 20.326 7.897 1.00 0.00 O ATOM 254 CG2 THR A 78 -4.983 20.219 5.489 1.00 0.00 C ATOM 0 H THR A 78 -3.646 17.876 5.056 1.00 0.00 H new ATOM 0 HA THR A 78 -4.202 17.777 7.837 1.00 0.00 H new ATOM 0 HB THR A 78 -3.268 19.742 6.674 1.00 0.00 H new ATOM 0 HG1 THR A 78 -4.658 21.284 7.798 1.00 0.00 H new ATOM 0 HG21 THR A 78 -4.763 21.285 5.440 1.00 0.00 H new ATOM 0 HG22 THR A 78 -4.576 19.724 4.608 1.00 0.00 H new ATOM 0 HG23 THR A 78 -6.063 20.072 5.521 1.00 0.00 H new ATOM 262 N GLU A 79 -6.688 17.488 5.721 1.00 0.00 N ATOM 263 CA GLU A 79 -8.088 17.193 5.599 1.00 0.00 C ATOM 264 C GLU A 79 -8.296 15.682 5.567 1.00 0.00 C ATOM 265 O GLU A 79 -8.939 15.130 4.667 1.00 0.00 O ATOM 266 CB GLU A 79 -8.723 17.912 4.393 1.00 0.00 C ATOM 267 CG GLU A 79 -8.110 17.587 3.044 1.00 0.00 C ATOM 268 CD GLU A 79 -8.788 18.319 1.927 1.00 0.00 C ATOM 269 OE1 GLU A 79 -9.915 17.955 1.551 1.00 0.00 O ATOM 270 OE2 GLU A 79 -8.203 19.279 1.390 1.00 0.00 O ATOM 0 H GLU A 79 -6.171 17.449 4.843 1.00 0.00 H new ATOM 0 HA GLU A 79 -8.608 17.581 6.475 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -9.784 17.663 4.360 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -8.653 18.988 4.555 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -7.051 17.845 3.056 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -8.175 16.514 2.866 1.00 0.00 H new ATOM 277 N ALA A 80 -7.746 15.018 6.589 1.00 0.00 N ATOM 278 CA ALA A 80 -7.808 13.561 6.738 1.00 0.00 C ATOM 279 C ALA A 80 -9.257 13.074 6.724 1.00 0.00 C ATOM 280 O ALA A 80 -9.552 11.953 6.308 1.00 0.00 O ATOM 281 CB ALA A 80 -7.116 13.133 8.023 1.00 0.00 C ATOM 0 H ALA A 80 -7.240 15.482 7.343 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.289 13.108 5.893 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.169 12.049 8.121 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -6.072 13.444 7.995 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -7.610 13.599 8.875 1.00 0.00 H new ATOM 287 N ASP A 81 -10.143 13.939 7.168 1.00 0.00 N ATOM 288 CA ASP A 81 -11.589 13.718 7.152 1.00 0.00 C ATOM 289 C ASP A 81 -12.100 13.412 5.734 1.00 0.00 C ATOM 290 O ASP A 81 -13.008 12.612 5.541 1.00 0.00 O ATOM 291 CB ASP A 81 -12.290 14.988 7.673 1.00 0.00 C ATOM 292 CG ASP A 81 -13.791 14.993 7.443 1.00 0.00 C ATOM 293 OD1 ASP A 81 -14.544 14.510 8.307 1.00 0.00 O ATOM 294 OD2 ASP A 81 -14.240 15.495 6.387 1.00 0.00 O ATOM 0 H ASP A 81 -9.880 14.842 7.562 1.00 0.00 H new ATOM 0 HA ASP A 81 -11.812 12.860 7.786 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -12.094 15.089 8.741 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -11.853 15.860 7.185 1.00 0.00 H new ATOM 299 N SER A 82 -11.472 14.005 4.761 1.00 0.00 N ATOM 300 CA SER A 82 -11.930 13.938 3.405 1.00 0.00 C ATOM 301 C SER A 82 -11.216 12.848 2.579 1.00 0.00 C ATOM 302 O SER A 82 -11.335 12.805 1.343 1.00 0.00 O ATOM 303 CB SER A 82 -11.766 15.314 2.806 1.00 0.00 C ATOM 304 OG SER A 82 -12.405 16.258 3.661 1.00 0.00 O ATOM 0 H SER A 82 -10.621 14.553 4.888 1.00 0.00 H new ATOM 0 HA SER A 82 -12.979 13.642 3.388 1.00 0.00 H new ATOM 0 HB2 SER A 82 -10.709 15.556 2.697 1.00 0.00 H new ATOM 0 HB3 SER A 82 -12.205 15.348 1.809 1.00 0.00 H new ATOM 0 HG SER A 82 -12.306 17.158 3.286 1.00 0.00 H new ATOM 310 N ILE A 83 -10.493 11.969 3.254 1.00 0.00 N ATOM 311 CA ILE A 83 -9.851 10.858 2.587 1.00 0.00 C ATOM 312 C ILE A 83 -10.907 9.756 2.377 1.00 0.00 C ATOM 313 O ILE A 83 -11.625 9.408 3.318 1.00 0.00 O ATOM 314 CB ILE A 83 -8.657 10.291 3.415 1.00 0.00 C ATOM 315 CG1 ILE A 83 -7.672 11.411 3.796 1.00 0.00 C ATOM 316 CG2 ILE A 83 -7.930 9.182 2.653 1.00 0.00 C ATOM 317 CD1 ILE A 83 -7.117 12.202 2.629 1.00 0.00 C ATOM 0 H ILE A 83 -10.339 12.007 4.262 1.00 0.00 H new ATOM 0 HA ILE A 83 -9.446 11.203 1.636 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.066 9.863 4.330 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -8.174 12.099 4.476 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -6.840 10.971 4.345 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -7.103 8.808 3.257 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.625 8.368 2.444 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.543 9.579 1.714 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -6.434 12.966 3.000 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -6.581 11.532 1.957 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -7.936 12.678 2.090 1.00 0.00 H new ATOM 329 N PRO A 84 -11.059 9.249 1.139 1.00 0.00 N ATOM 330 CA PRO A 84 -12.051 8.207 0.810 1.00 0.00 C ATOM 331 C PRO A 84 -11.900 6.912 1.631 1.00 0.00 C ATOM 332 O PRO A 84 -10.817 6.322 1.715 1.00 0.00 O ATOM 333 CB PRO A 84 -11.787 7.917 -0.665 1.00 0.00 C ATOM 334 CG PRO A 84 -11.151 9.154 -1.177 1.00 0.00 C ATOM 335 CD PRO A 84 -10.314 9.675 -0.055 1.00 0.00 C ATOM 0 HA PRO A 84 -13.059 8.554 1.035 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -11.133 7.054 -0.789 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -12.712 7.696 -1.198 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -10.541 8.945 -2.056 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -11.902 9.885 -1.477 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -9.308 9.256 -0.074 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -10.209 10.759 -0.100 1.00 0.00 H new ATOM 343 N SER A 85 -12.994 6.457 2.183 1.00 0.00 N ATOM 344 CA SER A 85 -13.051 5.247 2.984 1.00 0.00 C ATOM 345 C SER A 85 -13.422 4.035 2.111 1.00 0.00 C ATOM 346 O SER A 85 -14.001 3.054 2.567 1.00 0.00 O ATOM 347 CB SER A 85 -14.061 5.479 4.103 1.00 0.00 C ATOM 348 OG SER A 85 -15.189 6.201 3.610 1.00 0.00 O ATOM 0 H SER A 85 -13.896 6.924 2.090 1.00 0.00 H new ATOM 0 HA SER A 85 -12.076 5.024 3.418 1.00 0.00 H new ATOM 0 HB2 SER A 85 -14.384 4.523 4.514 1.00 0.00 H new ATOM 0 HB3 SER A 85 -13.592 6.034 4.916 1.00 0.00 H new ATOM 0 HG SER A 85 -15.831 6.342 4.337 1.00 0.00 H new ATOM 354 N ALA A 86 -13.002 4.099 0.883 1.00 0.00 N ATOM 355 CA ALA A 86 -13.298 3.087 -0.095 1.00 0.00 C ATOM 356 C ALA A 86 -12.071 2.225 -0.343 1.00 0.00 C ATOM 357 O ALA A 86 -11.024 2.448 0.264 1.00 0.00 O ATOM 358 CB ALA A 86 -13.737 3.759 -1.366 1.00 0.00 C ATOM 0 H ALA A 86 -12.435 4.867 0.524 1.00 0.00 H new ATOM 0 HA ALA A 86 -14.097 2.441 0.269 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -13.965 3.003 -2.117 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -14.627 4.358 -1.172 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -12.938 4.404 -1.731 1.00 0.00 H new ATOM 364 N SER A 87 -12.187 1.273 -1.224 1.00 0.00 N ATOM 365 CA SER A 87 -11.107 0.376 -1.514 1.00 0.00 C ATOM 366 C SER A 87 -10.310 0.904 -2.700 1.00 0.00 C ATOM 367 O SER A 87 -10.861 1.577 -3.581 1.00 0.00 O ATOM 368 CB SER A 87 -11.679 -1.016 -1.830 1.00 0.00 C ATOM 369 OG SER A 87 -10.666 -2.023 -1.890 1.00 0.00 O ATOM 0 H SER A 87 -13.035 1.097 -1.762 1.00 0.00 H new ATOM 0 HA SER A 87 -10.443 0.302 -0.652 1.00 0.00 H new ATOM 0 HB2 SER A 87 -12.411 -1.286 -1.069 1.00 0.00 H new ATOM 0 HB3 SER A 87 -12.208 -0.980 -2.782 1.00 0.00 H new ATOM 0 HG SER A 87 -11.077 -2.889 -2.091 1.00 0.00 H new ATOM 375 N GLY A 88 -9.024 0.644 -2.706 1.00 0.00 N ATOM 376 CA GLY A 88 -8.234 1.031 -3.819 1.00 0.00 C ATOM 377 C GLY A 88 -6.790 1.186 -3.474 1.00 0.00 C ATOM 378 O GLY A 88 -6.279 0.537 -2.540 1.00 0.00 O ATOM 0 H GLY A 88 -8.520 0.171 -1.956 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -8.337 0.287 -4.609 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -8.611 1.973 -4.217 1.00 0.00 H new ATOM 382 N VAL A 89 -6.158 2.067 -4.188 1.00 0.00 N ATOM 383 CA VAL A 89 -4.749 2.339 -4.081 1.00 0.00 C ATOM 384 C VAL A 89 -4.542 3.759 -3.588 1.00 0.00 C ATOM 385 O VAL A 89 -5.375 4.634 -3.836 1.00 0.00 O ATOM 386 CB VAL A 89 -4.027 2.145 -5.464 1.00 0.00 C ATOM 387 CG1 VAL A 89 -3.760 0.697 -5.744 1.00 0.00 C ATOM 388 CG2 VAL A 89 -4.871 2.694 -6.600 1.00 0.00 C ATOM 0 H VAL A 89 -6.624 2.641 -4.890 1.00 0.00 H new ATOM 0 HA VAL A 89 -4.316 1.635 -3.370 1.00 0.00 H new ATOM 0 HB VAL A 89 -3.083 2.687 -5.401 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -3.260 0.599 -6.708 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -3.122 0.287 -4.961 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -4.703 0.151 -5.767 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -4.349 2.547 -7.545 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -5.827 2.171 -6.629 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.044 3.759 -6.443 1.00 0.00 H new ATOM 398 N TYR A 90 -3.482 3.987 -2.868 1.00 0.00 N ATOM 399 CA TYR A 90 -3.169 5.314 -2.402 1.00 0.00 C ATOM 400 C TYR A 90 -1.668 5.516 -2.409 1.00 0.00 C ATOM 401 O TYR A 90 -0.908 4.542 -2.411 1.00 0.00 O ATOM 402 CB TYR A 90 -3.762 5.598 -1.001 1.00 0.00 C ATOM 403 CG TYR A 90 -3.151 4.819 0.154 1.00 0.00 C ATOM 404 CD1 TYR A 90 -2.041 5.316 0.822 1.00 0.00 C ATOM 405 CD2 TYR A 90 -3.695 3.617 0.592 1.00 0.00 C ATOM 406 CE1 TYR A 90 -1.484 4.646 1.879 1.00 0.00 C ATOM 407 CE2 TYR A 90 -3.141 2.939 1.666 1.00 0.00 C ATOM 408 CZ TYR A 90 -2.031 3.464 2.302 1.00 0.00 C ATOM 409 OH TYR A 90 -1.469 2.810 3.376 1.00 0.00 O ATOM 0 H TYR A 90 -2.814 3.269 -2.588 1.00 0.00 H new ATOM 0 HA TYR A 90 -3.631 6.028 -3.084 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -3.654 6.662 -0.792 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -4.831 5.385 -1.031 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.607 6.251 0.502 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -4.559 3.207 0.090 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -0.615 5.049 2.378 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -3.573 2.008 2.004 1.00 0.00 H new ATOM 0 HH TYR A 90 -1.969 1.987 3.556 1.00 0.00 H new ATOM 419 N ALA A 91 -1.248 6.747 -2.403 1.00 0.00 N ATOM 420 CA ALA A 91 0.150 7.081 -2.439 1.00 0.00 C ATOM 421 C ALA A 91 0.440 8.257 -1.543 1.00 0.00 C ATOM 422 O ALA A 91 -0.239 9.268 -1.610 1.00 0.00 O ATOM 423 CB ALA A 91 0.540 7.407 -3.842 1.00 0.00 C ATOM 0 H ALA A 91 -1.869 7.556 -2.373 1.00 0.00 H new ATOM 0 HA ALA A 91 0.727 6.228 -2.082 1.00 0.00 H new ATOM 0 HB1 ALA A 91 1.599 7.661 -3.875 1.00 0.00 H new ATOM 0 HB2 ALA A 91 0.353 6.544 -4.481 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -0.048 8.254 -4.195 1.00 0.00 H new ATOM 429 N VAL A 92 1.448 8.129 -0.729 1.00 0.00 N ATOM 430 CA VAL A 92 1.805 9.148 0.221 1.00 0.00 C ATOM 431 C VAL A 92 3.082 9.882 -0.224 1.00 0.00 C ATOM 432 O VAL A 92 4.128 9.246 -0.521 1.00 0.00 O ATOM 433 CB VAL A 92 2.008 8.543 1.632 1.00 0.00 C ATOM 434 CG1 VAL A 92 2.242 9.635 2.652 1.00 0.00 C ATOM 435 CG2 VAL A 92 0.804 7.698 2.029 1.00 0.00 C ATOM 0 H VAL A 92 2.052 7.307 -0.704 1.00 0.00 H new ATOM 0 HA VAL A 92 0.985 9.864 0.265 1.00 0.00 H new ATOM 0 HB VAL A 92 2.889 7.902 1.605 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.382 9.189 3.637 1.00 0.00 H new ATOM 0 HG12 VAL A 92 3.132 10.202 2.380 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.380 10.302 2.675 1.00 0.00 H new ATOM 0 HG21 VAL A 92 0.964 7.281 3.023 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.091 8.320 2.036 1.00 0.00 H new ATOM 0 HG23 VAL A 92 0.676 6.887 1.312 1.00 0.00 H new ATOM 445 N TYR A 93 2.982 11.191 -0.282 1.00 0.00 N ATOM 446 CA TYR A 93 4.057 12.079 -0.677 1.00 0.00 C ATOM 447 C TYR A 93 4.464 12.902 0.520 1.00 0.00 C ATOM 448 O TYR A 93 3.603 13.438 1.220 1.00 0.00 O ATOM 449 CB TYR A 93 3.583 13.035 -1.779 1.00 0.00 C ATOM 450 CG TYR A 93 3.258 12.395 -3.105 1.00 0.00 C ATOM 451 CD1 TYR A 93 2.135 11.598 -3.270 1.00 0.00 C ATOM 452 CD2 TYR A 93 4.067 12.614 -4.201 1.00 0.00 C ATOM 453 CE1 TYR A 93 1.840 11.040 -4.489 1.00 0.00 C ATOM 454 CE2 TYR A 93 3.779 12.057 -5.420 1.00 0.00 C ATOM 455 CZ TYR A 93 2.669 11.275 -5.561 1.00 0.00 C ATOM 456 OH TYR A 93 2.372 10.736 -6.788 1.00 0.00 O ATOM 0 H TYR A 93 2.121 11.685 -0.048 1.00 0.00 H new ATOM 0 HA TYR A 93 4.892 11.485 -1.049 1.00 0.00 H new ATOM 0 HB2 TYR A 93 2.696 13.560 -1.423 1.00 0.00 H new ATOM 0 HB3 TYR A 93 4.356 13.787 -1.939 1.00 0.00 H new ATOM 0 HD1 TYR A 93 1.484 11.414 -2.428 1.00 0.00 H new ATOM 0 HD2 TYR A 93 4.944 13.236 -4.097 1.00 0.00 H new ATOM 0 HE1 TYR A 93 0.963 10.421 -4.605 1.00 0.00 H new ATOM 0 HE2 TYR A 93 4.427 12.236 -6.265 1.00 0.00 H new ATOM 0 HH TYR A 93 3.202 10.477 -7.241 1.00 0.00 H new ATOM 466 N ASP A 94 5.744 13.039 0.748 1.00 0.00 N ATOM 467 CA ASP A 94 6.211 13.777 1.913 1.00 0.00 C ATOM 468 C ASP A 94 6.286 15.279 1.605 1.00 0.00 C ATOM 469 O ASP A 94 5.828 15.739 0.544 1.00 0.00 O ATOM 470 CB ASP A 94 7.581 13.262 2.406 1.00 0.00 C ATOM 471 CG ASP A 94 8.764 13.785 1.614 1.00 0.00 C ATOM 472 OD1 ASP A 94 8.960 13.393 0.467 1.00 0.00 O ATOM 473 OD2 ASP A 94 9.510 14.630 2.153 1.00 0.00 O ATOM 0 H ASP A 94 6.482 12.658 0.156 1.00 0.00 H new ATOM 0 HA ASP A 94 5.489 13.615 2.713 1.00 0.00 H new ATOM 0 HB2 ASP A 94 7.706 13.541 3.452 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.583 12.173 2.365 1.00 0.00 H new ATOM 478 N LYS A 95 6.887 16.032 2.520 1.00 0.00 N ATOM 479 CA LYS A 95 7.010 17.474 2.423 1.00 0.00 C ATOM 480 C LYS A 95 7.849 17.883 1.205 1.00 0.00 C ATOM 481 O LYS A 95 7.691 18.983 0.677 1.00 0.00 O ATOM 482 CB LYS A 95 7.640 18.069 3.698 1.00 0.00 C ATOM 483 CG LYS A 95 6.984 17.666 5.024 1.00 0.00 C ATOM 484 CD LYS A 95 7.656 16.451 5.669 1.00 0.00 C ATOM 485 CE LYS A 95 7.035 16.116 7.007 1.00 0.00 C ATOM 486 NZ LYS A 95 7.731 14.990 7.659 1.00 0.00 N ATOM 0 H LYS A 95 7.309 15.645 3.364 1.00 0.00 H new ATOM 0 HA LYS A 95 6.001 17.870 2.307 1.00 0.00 H new ATOM 0 HB2 LYS A 95 8.689 17.776 3.731 1.00 0.00 H new ATOM 0 HB3 LYS A 95 7.615 19.156 3.619 1.00 0.00 H new ATOM 0 HG2 LYS A 95 7.024 18.508 5.715 1.00 0.00 H new ATOM 0 HG3 LYS A 95 5.931 17.445 4.851 1.00 0.00 H new ATOM 0 HD2 LYS A 95 7.572 15.592 5.003 1.00 0.00 H new ATOM 0 HD3 LYS A 95 8.720 16.650 5.800 1.00 0.00 H new ATOM 0 HE2 LYS A 95 7.070 16.992 7.655 1.00 0.00 H new ATOM 0 HE3 LYS A 95 5.984 15.864 6.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 7.122 14.588 8.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 7.945 14.258 6.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 8.617 15.329 8.085 1.00 0.00 H new ATOM 500 N SER A 96 8.729 16.994 0.758 1.00 0.00 N ATOM 501 CA SER A 96 9.569 17.253 -0.400 1.00 0.00 C ATOM 502 C SER A 96 8.812 16.963 -1.711 1.00 0.00 C ATOM 503 O SER A 96 9.405 17.004 -2.804 1.00 0.00 O ATOM 504 CB SER A 96 10.820 16.403 -0.314 1.00 0.00 C ATOM 505 OG SER A 96 11.429 16.551 0.962 1.00 0.00 O ATOM 0 H SER A 96 8.878 16.080 1.186 1.00 0.00 H new ATOM 0 HA SER A 96 9.845 18.307 -0.403 1.00 0.00 H new ATOM 0 HB2 SER A 96 10.569 15.356 -0.486 1.00 0.00 H new ATOM 0 HB3 SER A 96 11.521 16.695 -1.096 1.00 0.00 H new ATOM 0 HG SER A 96 10.954 15.998 1.617 1.00 0.00 H new ATOM 511 N ASP A 97 7.511 16.629 -1.576 1.00 0.00 N ATOM 512 CA ASP A 97 6.574 16.425 -2.709 1.00 0.00 C ATOM 513 C ASP A 97 6.910 15.148 -3.500 1.00 0.00 C ATOM 514 O ASP A 97 6.460 14.940 -4.623 1.00 0.00 O ATOM 515 CB ASP A 97 6.538 17.702 -3.610 1.00 0.00 C ATOM 516 CG ASP A 97 5.551 17.649 -4.768 1.00 0.00 C ATOM 517 OD1 ASP A 97 4.326 17.862 -4.550 1.00 0.00 O ATOM 518 OD2 ASP A 97 5.979 17.423 -5.913 1.00 0.00 O ATOM 0 H ASP A 97 7.073 16.491 -0.665 1.00 0.00 H new ATOM 0 HA ASP A 97 5.570 16.274 -2.312 1.00 0.00 H new ATOM 0 HB2 ASP A 97 6.295 18.562 -2.985 1.00 0.00 H new ATOM 0 HB3 ASP A 97 7.537 17.872 -4.012 1.00 0.00 H new ATOM 523 N GLU A 98 7.652 14.254 -2.895 1.00 0.00 N ATOM 524 CA GLU A 98 7.993 13.056 -3.592 1.00 0.00 C ATOM 525 C GLU A 98 7.308 11.850 -2.993 1.00 0.00 C ATOM 526 O GLU A 98 7.040 11.788 -1.781 1.00 0.00 O ATOM 527 CB GLU A 98 9.502 12.863 -3.723 1.00 0.00 C ATOM 528 CG GLU A 98 10.244 12.614 -2.445 1.00 0.00 C ATOM 529 CD GLU A 98 11.717 12.601 -2.681 1.00 0.00 C ATOM 530 OE1 GLU A 98 12.198 11.846 -3.555 1.00 0.00 O ATOM 531 OE2 GLU A 98 12.436 13.364 -2.014 1.00 0.00 O ATOM 0 H GLU A 98 8.019 14.335 -1.947 1.00 0.00 H new ATOM 0 HA GLU A 98 7.616 13.165 -4.609 1.00 0.00 H new ATOM 0 HB2 GLU A 98 9.684 12.025 -4.396 1.00 0.00 H new ATOM 0 HB3 GLU A 98 9.922 13.750 -4.198 1.00 0.00 H new ATOM 0 HG2 GLU A 98 9.995 13.387 -1.718 1.00 0.00 H new ATOM 0 HG3 GLU A 98 9.931 11.661 -2.017 1.00 0.00 H new ATOM 538 N LEU A 99 6.996 10.920 -3.856 1.00 0.00 N ATOM 539 CA LEU A 99 6.327 9.708 -3.489 1.00 0.00 C ATOM 540 C LEU A 99 7.313 8.767 -2.874 1.00 0.00 C ATOM 541 O LEU A 99 8.354 8.476 -3.466 1.00 0.00 O ATOM 542 CB LEU A 99 5.643 9.098 -4.740 1.00 0.00 C ATOM 543 CG LEU A 99 4.894 7.743 -4.624 1.00 0.00 C ATOM 544 CD1 LEU A 99 5.849 6.546 -4.601 1.00 0.00 C ATOM 545 CD2 LEU A 99 4.011 7.742 -3.399 1.00 0.00 C ATOM 0 H LEU A 99 7.205 10.988 -4.852 1.00 0.00 H new ATOM 0 HA LEU A 99 5.550 9.908 -2.751 1.00 0.00 H new ATOM 0 HB2 LEU A 99 4.930 9.833 -5.112 1.00 0.00 H new ATOM 0 HB3 LEU A 99 6.410 8.982 -5.506 1.00 0.00 H new ATOM 0 HG LEU A 99 4.276 7.636 -5.515 1.00 0.00 H new ATOM 0 HD11 LEU A 99 5.274 5.624 -4.519 1.00 0.00 H new ATOM 0 HD12 LEU A 99 6.433 6.529 -5.521 1.00 0.00 H new ATOM 0 HD13 LEU A 99 6.520 6.633 -3.747 1.00 0.00 H new ATOM 0 HD21 LEU A 99 3.490 6.787 -3.327 1.00 0.00 H new ATOM 0 HD22 LEU A 99 4.623 7.890 -2.509 1.00 0.00 H new ATOM 0 HD23 LEU A 99 3.282 8.548 -3.476 1.00 0.00 H new ATOM 557 N GLN A 100 6.996 8.313 -1.697 1.00 0.00 N ATOM 558 CA GLN A 100 7.832 7.377 -1.003 1.00 0.00 C ATOM 559 C GLN A 100 7.067 6.145 -0.530 1.00 0.00 C ATOM 560 O GLN A 100 7.667 5.161 -0.125 1.00 0.00 O ATOM 561 CB GLN A 100 8.638 8.052 0.105 1.00 0.00 C ATOM 562 CG GLN A 100 9.721 8.972 -0.451 1.00 0.00 C ATOM 563 CD GLN A 100 10.536 9.649 0.604 1.00 0.00 C ATOM 564 OE1 GLN A 100 11.546 9.117 1.058 1.00 0.00 O ATOM 565 NE2 GLN A 100 10.153 10.831 0.967 1.00 0.00 N ATOM 0 H GLN A 100 6.152 8.581 -1.191 1.00 0.00 H new ATOM 0 HA GLN A 100 8.559 7.002 -1.723 1.00 0.00 H new ATOM 0 HB2 GLN A 100 7.966 8.627 0.742 1.00 0.00 H new ATOM 0 HB3 GLN A 100 9.098 7.290 0.734 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.384 8.391 -1.093 1.00 0.00 H new ATOM 0 HG3 GLN A 100 9.253 9.731 -1.079 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.308 11.239 0.567 1.00 0.00 H new ATOM 0 HE22 GLN A 100 10.696 11.355 1.653 1.00 0.00 H new ATOM 574 N PHE A 101 5.748 6.200 -0.547 1.00 0.00 N ATOM 575 CA PHE A 101 4.979 5.027 -0.177 1.00 0.00 C ATOM 576 C PHE A 101 3.664 4.925 -0.931 1.00 0.00 C ATOM 577 O PHE A 101 2.831 5.822 -0.865 1.00 0.00 O ATOM 578 CB PHE A 101 4.729 4.964 1.345 1.00 0.00 C ATOM 579 CG PHE A 101 3.877 3.789 1.761 1.00 0.00 C ATOM 580 CD1 PHE A 101 4.409 2.512 1.813 1.00 0.00 C ATOM 581 CD2 PHE A 101 2.538 3.966 2.075 1.00 0.00 C ATOM 582 CE1 PHE A 101 3.622 1.436 2.166 1.00 0.00 C ATOM 583 CE2 PHE A 101 1.752 2.896 2.433 1.00 0.00 C ATOM 584 CZ PHE A 101 2.291 1.630 2.477 1.00 0.00 C ATOM 0 H PHE A 101 5.199 7.020 -0.805 1.00 0.00 H new ATOM 0 HA PHE A 101 5.588 4.170 -0.464 1.00 0.00 H new ATOM 0 HB2 PHE A 101 5.687 4.910 1.862 1.00 0.00 H new ATOM 0 HB3 PHE A 101 4.245 5.887 1.665 1.00 0.00 H new ATOM 0 HD1 PHE A 101 5.451 2.357 1.575 1.00 0.00 H new ATOM 0 HD2 PHE A 101 2.107 4.956 2.038 1.00 0.00 H new ATOM 0 HE1 PHE A 101 4.046 0.443 2.199 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.712 3.049 2.680 1.00 0.00 H new ATOM 0 HZ PHE A 101 1.673 0.789 2.755 1.00 0.00 H new ATOM 594 N VAL A 102 3.498 3.846 -1.655 1.00 0.00 N ATOM 595 CA VAL A 102 2.217 3.522 -2.271 1.00 0.00 C ATOM 596 C VAL A 102 1.628 2.320 -1.560 1.00 0.00 C ATOM 597 O VAL A 102 2.363 1.408 -1.164 1.00 0.00 O ATOM 598 CB VAL A 102 2.284 3.255 -3.814 1.00 0.00 C ATOM 599 CG1 VAL A 102 2.603 4.516 -4.563 1.00 0.00 C ATOM 600 CG2 VAL A 102 3.302 2.193 -4.158 1.00 0.00 C ATOM 0 H VAL A 102 4.236 3.166 -1.838 1.00 0.00 H new ATOM 0 HA VAL A 102 1.584 4.402 -2.161 1.00 0.00 H new ATOM 0 HB VAL A 102 1.300 2.896 -4.115 1.00 0.00 H new ATOM 0 HG11 VAL A 102 2.644 4.304 -5.631 1.00 0.00 H new ATOM 0 HG12 VAL A 102 1.830 5.259 -4.370 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.568 4.901 -4.232 1.00 0.00 H new ATOM 0 HG21 VAL A 102 3.316 2.039 -5.237 1.00 0.00 H new ATOM 0 HG22 VAL A 102 4.289 2.513 -3.824 1.00 0.00 H new ATOM 0 HG23 VAL A 102 3.036 1.260 -3.662 1.00 0.00 H new ATOM 610 N GLY A 103 0.347 2.309 -1.375 1.00 0.00 N ATOM 611 CA GLY A 103 -0.263 1.230 -0.661 1.00 0.00 C ATOM 612 C GLY A 103 -1.628 0.907 -1.174 1.00 0.00 C ATOM 613 O GLY A 103 -2.203 1.673 -1.947 1.00 0.00 O ATOM 0 H GLY A 103 -0.295 3.029 -1.705 1.00 0.00 H new ATOM 0 HA2 GLY A 103 0.369 0.345 -0.736 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -0.327 1.488 0.396 1.00 0.00 H new ATOM 617 N ILE A 104 -2.141 -0.213 -0.745 1.00 0.00 N ATOM 618 CA ILE A 104 -3.453 -0.681 -1.119 1.00 0.00 C ATOM 619 C ILE A 104 -4.244 -0.964 0.129 1.00 0.00 C ATOM 620 O ILE A 104 -3.662 -1.325 1.157 1.00 0.00 O ATOM 621 CB ILE A 104 -3.388 -1.960 -2.006 1.00 0.00 C ATOM 622 CG1 ILE A 104 -2.478 -3.040 -1.389 1.00 0.00 C ATOM 623 CG2 ILE A 104 -2.942 -1.611 -3.400 1.00 0.00 C ATOM 624 CD1 ILE A 104 -2.392 -4.319 -2.210 1.00 0.00 C ATOM 0 H ILE A 104 -1.649 -0.843 -0.111 1.00 0.00 H new ATOM 0 HA ILE A 104 -3.937 0.097 -1.709 1.00 0.00 H new ATOM 0 HB ILE A 104 -4.393 -2.379 -2.057 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -1.475 -2.630 -1.268 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.845 -3.284 -0.392 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -2.902 -2.516 -4.006 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -3.648 -0.908 -3.843 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.952 -1.156 -3.362 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -1.733 -5.029 -1.710 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.386 -4.755 -2.310 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -1.995 -4.090 -3.199 1.00 0.00 H new ATOM 636 N SER A 105 -5.535 -0.769 0.070 1.00 0.00 N ATOM 637 CA SER A 105 -6.377 -1.021 1.207 1.00 0.00 C ATOM 638 C SER A 105 -7.810 -1.267 0.751 1.00 0.00 C ATOM 639 O SER A 105 -8.182 -0.963 -0.404 1.00 0.00 O ATOM 640 CB SER A 105 -6.322 0.169 2.191 1.00 0.00 C ATOM 641 OG SER A 105 -7.072 -0.090 3.379 1.00 0.00 O ATOM 0 H SER A 105 -6.027 -0.435 -0.758 1.00 0.00 H new ATOM 0 HA SER A 105 -6.015 -1.911 1.722 1.00 0.00 H new ATOM 0 HB2 SER A 105 -5.285 0.376 2.454 1.00 0.00 H new ATOM 0 HB3 SER A 105 -6.711 1.063 1.703 1.00 0.00 H new ATOM 0 HG SER A 105 -6.708 -0.880 3.830 1.00 0.00 H new ATOM 647 N ARG A 106 -8.606 -1.824 1.642 1.00 0.00 N ATOM 648 CA ARG A 106 -10.004 -2.061 1.374 1.00 0.00 C ATOM 649 C ARG A 106 -10.782 -0.838 1.871 1.00 0.00 C ATOM 650 O ARG A 106 -11.922 -0.603 1.486 1.00 0.00 O ATOM 651 CB ARG A 106 -10.476 -3.361 2.070 1.00 0.00 C ATOM 652 CG ARG A 106 -11.396 -4.231 1.203 1.00 0.00 C ATOM 653 CD ARG A 106 -12.752 -3.589 0.932 1.00 0.00 C ATOM 654 NE ARG A 106 -13.689 -3.755 2.051 1.00 0.00 N ATOM 655 CZ ARG A 106 -14.579 -2.839 2.463 1.00 0.00 C ATOM 656 NH1 ARG A 106 -14.416 -1.556 2.160 1.00 0.00 N ATOM 657 NH2 ARG A 106 -15.577 -3.202 3.243 1.00 0.00 N ATOM 0 H ARG A 106 -8.300 -2.123 2.568 1.00 0.00 H new ATOM 0 HA ARG A 106 -10.178 -2.198 0.307 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -9.602 -3.946 2.356 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -11.000 -3.100 2.990 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -10.902 -4.436 0.253 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -11.548 -5.191 1.696 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -12.614 -2.526 0.733 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -13.184 -4.028 0.033 1.00 0.00 H new ATOM 0 HE ARG A 106 -13.661 -4.640 2.557 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -13.609 -1.260 1.610 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -15.097 -0.866 2.477 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -15.671 -4.176 3.531 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -16.256 -2.509 3.559 1.00 0.00 H new ATOM 671 N ASN A 107 -10.129 -0.066 2.721 1.00 0.00 N ATOM 672 CA ASN A 107 -10.678 1.166 3.250 1.00 0.00 C ATOM 673 C ASN A 107 -9.517 2.167 3.355 1.00 0.00 C ATOM 674 O ASN A 107 -8.858 2.249 4.405 1.00 0.00 O ATOM 675 CB ASN A 107 -11.285 0.934 4.648 1.00 0.00 C ATOM 676 CG ASN A 107 -12.103 2.111 5.181 1.00 0.00 C ATOM 677 OD1 ASN A 107 -13.321 2.104 5.154 1.00 0.00 O ATOM 678 ND2 ASN A 107 -11.438 3.150 5.584 1.00 0.00 N ATOM 0 H ASN A 107 -9.193 -0.280 3.066 1.00 0.00 H new ATOM 0 HA ASN A 107 -11.469 1.539 2.599 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -11.922 0.050 4.613 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -10.479 0.719 5.350 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -11.935 3.987 5.888 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -10.418 3.129 5.597 1.00 0.00 H new ATOM 685 N ILE A 108 -9.255 2.886 2.269 1.00 0.00 N ATOM 686 CA ILE A 108 -8.104 3.807 2.131 1.00 0.00 C ATOM 687 C ILE A 108 -7.926 4.742 3.341 1.00 0.00 C ATOM 688 O ILE A 108 -6.856 4.753 3.969 1.00 0.00 O ATOM 689 CB ILE A 108 -8.203 4.637 0.809 1.00 0.00 C ATOM 690 CG1 ILE A 108 -8.165 3.706 -0.416 1.00 0.00 C ATOM 691 CG2 ILE A 108 -7.091 5.677 0.722 1.00 0.00 C ATOM 692 CD1 ILE A 108 -8.319 4.418 -1.749 1.00 0.00 C ATOM 0 H ILE A 108 -9.842 2.853 1.436 1.00 0.00 H new ATOM 0 HA ILE A 108 -7.217 3.176 2.089 1.00 0.00 H new ATOM 0 HB ILE A 108 -9.156 5.166 0.818 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -7.220 3.162 -0.415 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -8.959 2.965 -0.319 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -7.188 6.237 -0.208 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -7.166 6.362 1.567 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -6.123 5.177 0.745 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -8.281 3.688 -2.558 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -9.276 4.939 -1.775 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -7.511 5.139 -1.872 1.00 0.00 H new ATOM 704 N ALA A 109 -8.984 5.477 3.681 1.00 0.00 N ATOM 705 CA ALA A 109 -8.993 6.449 4.792 1.00 0.00 C ATOM 706 C ALA A 109 -8.466 5.884 6.105 1.00 0.00 C ATOM 707 O ALA A 109 -7.853 6.608 6.881 1.00 0.00 O ATOM 708 CB ALA A 109 -10.390 6.992 5.005 1.00 0.00 C ATOM 0 H ALA A 109 -9.876 5.419 3.190 1.00 0.00 H new ATOM 0 HA ALA A 109 -8.313 7.248 4.494 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -10.381 7.707 5.827 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -10.730 7.488 4.096 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -11.066 6.172 5.245 1.00 0.00 H new ATOM 714 N ALA A 110 -8.652 4.600 6.316 1.00 0.00 N ATOM 715 CA ALA A 110 -8.257 3.977 7.559 1.00 0.00 C ATOM 716 C ALA A 110 -6.754 3.848 7.609 1.00 0.00 C ATOM 717 O ALA A 110 -6.106 4.416 8.481 1.00 0.00 O ATOM 718 CB ALA A 110 -8.916 2.611 7.708 1.00 0.00 C ATOM 0 H ALA A 110 -9.076 3.965 5.640 1.00 0.00 H new ATOM 0 HA ALA A 110 -8.587 4.603 8.388 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -8.606 2.158 8.650 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -10.000 2.727 7.700 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -8.614 1.969 6.880 1.00 0.00 H new ATOM 724 N SER A 111 -6.206 3.161 6.622 1.00 0.00 N ATOM 725 CA SER A 111 -4.789 2.902 6.546 1.00 0.00 C ATOM 726 C SER A 111 -3.983 4.206 6.471 1.00 0.00 C ATOM 727 O SER A 111 -2.981 4.367 7.188 1.00 0.00 O ATOM 728 CB SER A 111 -4.518 2.018 5.335 1.00 0.00 C ATOM 729 OG SER A 111 -5.361 0.864 5.372 1.00 0.00 O ATOM 0 H SER A 111 -6.740 2.767 5.848 1.00 0.00 H new ATOM 0 HA SER A 111 -4.469 2.388 7.452 1.00 0.00 H new ATOM 0 HB2 SER A 111 -4.696 2.579 4.418 1.00 0.00 H new ATOM 0 HB3 SER A 111 -3.471 1.714 5.324 1.00 0.00 H new ATOM 0 HG SER A 111 -5.950 0.864 4.589 1.00 0.00 H new ATOM 735 N VAL A 112 -4.453 5.149 5.642 1.00 0.00 N ATOM 736 CA VAL A 112 -3.784 6.437 5.461 1.00 0.00 C ATOM 737 C VAL A 112 -3.666 7.182 6.781 1.00 0.00 C ATOM 738 O VAL A 112 -2.549 7.424 7.258 1.00 0.00 O ATOM 739 CB VAL A 112 -4.518 7.336 4.413 1.00 0.00 C ATOM 740 CG1 VAL A 112 -3.877 8.717 4.306 1.00 0.00 C ATOM 741 CG2 VAL A 112 -4.510 6.675 3.055 1.00 0.00 C ATOM 0 H VAL A 112 -5.300 5.038 5.085 1.00 0.00 H new ATOM 0 HA VAL A 112 -2.785 6.220 5.082 1.00 0.00 H new ATOM 0 HB VAL A 112 -5.545 7.460 4.756 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -4.415 9.312 3.568 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -3.921 9.215 5.275 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -2.836 8.612 3.999 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -5.025 7.313 2.337 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -3.481 6.521 2.731 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -5.019 5.713 3.116 1.00 0.00 H new ATOM 751 N SER A 113 -4.804 7.470 7.389 1.00 0.00 N ATOM 752 CA SER A 113 -4.855 8.253 8.606 1.00 0.00 C ATOM 753 C SER A 113 -4.082 7.563 9.728 1.00 0.00 C ATOM 754 O SER A 113 -3.277 8.198 10.419 1.00 0.00 O ATOM 755 CB SER A 113 -6.311 8.467 9.015 1.00 0.00 C ATOM 756 OG SER A 113 -7.084 8.935 7.909 1.00 0.00 O ATOM 0 H SER A 113 -5.717 7.166 7.051 1.00 0.00 H new ATOM 0 HA SER A 113 -4.388 9.220 8.422 1.00 0.00 H new ATOM 0 HB2 SER A 113 -6.730 7.532 9.388 1.00 0.00 H new ATOM 0 HB3 SER A 113 -6.362 9.187 9.831 1.00 0.00 H new ATOM 0 HG SER A 113 -7.681 8.221 7.601 1.00 0.00 H new ATOM 762 N ALA A 114 -4.275 6.256 9.857 1.00 0.00 N ATOM 763 CA ALA A 114 -3.647 5.488 10.900 1.00 0.00 C ATOM 764 C ALA A 114 -2.125 5.545 10.818 1.00 0.00 C ATOM 765 O ALA A 114 -1.452 5.877 11.814 1.00 0.00 O ATOM 766 CB ALA A 114 -4.137 4.053 10.882 1.00 0.00 C ATOM 0 H ALA A 114 -4.872 5.709 9.237 1.00 0.00 H new ATOM 0 HA ALA A 114 -3.934 5.939 11.850 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -3.649 3.492 11.679 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -5.216 4.035 11.034 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -3.899 3.599 9.920 1.00 0.00 H new ATOM 772 N HIS A 115 -1.558 5.275 9.646 1.00 0.00 N ATOM 773 CA HIS A 115 -0.106 5.250 9.571 1.00 0.00 C ATOM 774 C HIS A 115 0.488 6.648 9.544 1.00 0.00 C ATOM 775 O HIS A 115 1.614 6.826 9.932 1.00 0.00 O ATOM 776 CB HIS A 115 0.484 4.360 8.443 1.00 0.00 C ATOM 777 CG HIS A 115 0.498 4.930 7.047 1.00 0.00 C ATOM 778 ND1 HIS A 115 1.482 5.791 6.599 1.00 0.00 N ATOM 779 CD2 HIS A 115 -0.294 4.695 5.986 1.00 0.00 C ATOM 780 CE1 HIS A 115 1.290 6.053 5.325 1.00 0.00 C ATOM 781 NE2 HIS A 115 0.215 5.397 4.924 1.00 0.00 N ATOM 0 H HIS A 115 -2.054 5.080 8.776 1.00 0.00 H new ATOM 0 HA HIS A 115 0.199 4.763 10.497 1.00 0.00 H new ATOM 0 HB2 HIS A 115 1.509 4.107 8.714 1.00 0.00 H new ATOM 0 HB3 HIS A 115 -0.079 3.427 8.421 1.00 0.00 H new ATOM 0 HD1 HIS A 115 2.240 6.166 7.169 1.00 0.00 H new ATOM 0 HD2 HIS A 115 -1.172 4.067 5.973 1.00 0.00 H new ATOM 0 HE1 HIS A 115 1.905 6.694 4.711 1.00 0.00 H new ATOM 790 N LEU A 116 -0.263 7.629 9.088 1.00 0.00 N ATOM 791 CA LEU A 116 0.232 9.010 9.089 1.00 0.00 C ATOM 792 C LEU A 116 0.243 9.596 10.481 1.00 0.00 C ATOM 793 O LEU A 116 1.048 10.458 10.793 1.00 0.00 O ATOM 794 CB LEU A 116 -0.529 9.905 8.117 1.00 0.00 C ATOM 795 CG LEU A 116 -0.286 9.637 6.633 1.00 0.00 C ATOM 796 CD1 LEU A 116 -1.099 10.589 5.785 1.00 0.00 C ATOM 797 CD2 LEU A 116 1.199 9.766 6.301 1.00 0.00 C ATOM 0 H LEU A 116 -1.205 7.510 8.715 1.00 0.00 H new ATOM 0 HA LEU A 116 1.263 8.968 8.737 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -1.596 9.800 8.315 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -0.267 10.942 8.327 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.602 8.618 6.411 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -0.915 10.385 4.730 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -2.159 10.454 6.001 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -0.810 11.615 6.012 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.353 9.572 5.240 1.00 0.00 H new ATOM 0 HD22 LEU A 116 1.539 10.774 6.538 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.767 9.044 6.888 1.00 0.00 H new ATOM 809 N LYS A 117 -0.648 9.129 11.324 1.00 0.00 N ATOM 810 CA LYS A 117 -0.634 9.559 12.701 1.00 0.00 C ATOM 811 C LYS A 117 0.352 8.725 13.504 1.00 0.00 C ATOM 812 O LYS A 117 0.616 8.998 14.677 1.00 0.00 O ATOM 813 CB LYS A 117 -2.036 9.574 13.306 1.00 0.00 C ATOM 814 CG LYS A 117 -2.975 10.569 12.616 1.00 0.00 C ATOM 815 CD LYS A 117 -2.460 12.004 12.735 1.00 0.00 C ATOM 816 CE LYS A 117 -3.326 12.978 11.953 1.00 0.00 C ATOM 817 NZ LYS A 117 -2.868 14.377 12.106 1.00 0.00 N ATOM 0 H LYS A 117 -1.381 8.461 11.085 1.00 0.00 H new ATOM 0 HA LYS A 117 -0.289 10.592 12.738 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -2.464 8.574 13.241 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -1.966 9.823 14.365 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -3.077 10.304 11.564 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -3.968 10.500 13.059 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -2.439 12.297 13.785 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -1.434 12.054 12.369 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -3.314 12.706 10.897 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -4.359 12.896 12.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -3.487 15.007 11.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -2.904 14.646 13.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -1.891 14.462 11.759 1.00 0.00 H new ATOM 831 N SER A 118 0.882 7.701 12.876 1.00 0.00 N ATOM 832 CA SER A 118 1.957 6.948 13.457 1.00 0.00 C ATOM 833 C SER A 118 3.284 7.594 13.010 1.00 0.00 C ATOM 834 O SER A 118 4.114 7.962 13.834 1.00 0.00 O ATOM 835 CB SER A 118 1.864 5.481 13.033 1.00 0.00 C ATOM 836 OG SER A 118 0.571 4.955 13.356 1.00 0.00 O ATOM 0 H SER A 118 0.581 7.373 11.958 1.00 0.00 H new ATOM 0 HA SER A 118 1.900 6.965 14.545 1.00 0.00 H new ATOM 0 HB2 SER A 118 2.044 5.392 11.962 1.00 0.00 H new ATOM 0 HB3 SER A 118 2.637 4.900 13.535 1.00 0.00 H new ATOM 0 HG SER A 118 -0.080 5.252 12.686 1.00 0.00 H new ATOM 842 N VAL A 119 3.446 7.770 11.700 1.00 0.00 N ATOM 843 CA VAL A 119 4.594 8.426 11.142 1.00 0.00 C ATOM 844 C VAL A 119 4.239 9.699 10.388 1.00 0.00 C ATOM 845 O VAL A 119 3.770 9.663 9.246 1.00 0.00 O ATOM 846 CB VAL A 119 5.469 7.507 10.244 1.00 0.00 C ATOM 847 CG1 VAL A 119 6.129 6.496 11.089 1.00 0.00 C ATOM 848 CG2 VAL A 119 4.671 6.806 9.140 1.00 0.00 C ATOM 0 H VAL A 119 2.771 7.454 11.003 1.00 0.00 H new ATOM 0 HA VAL A 119 5.192 8.695 12.012 1.00 0.00 H new ATOM 0 HB VAL A 119 6.202 8.144 9.748 1.00 0.00 H new ATOM 0 HG11 VAL A 119 6.745 5.847 10.466 1.00 0.00 H new ATOM 0 HG12 VAL A 119 6.758 6.993 11.828 1.00 0.00 H new ATOM 0 HG13 VAL A 119 5.373 5.899 11.599 1.00 0.00 H new ATOM 0 HG21 VAL A 119 5.340 6.180 8.549 1.00 0.00 H new ATOM 0 HG22 VAL A 119 3.896 6.185 9.589 1.00 0.00 H new ATOM 0 HG23 VAL A 119 4.209 7.553 8.495 1.00 0.00 H new ATOM 858 N PRO A 120 4.470 10.858 11.014 1.00 0.00 N ATOM 859 CA PRO A 120 4.311 12.163 10.359 1.00 0.00 C ATOM 860 C PRO A 120 5.457 12.411 9.362 1.00 0.00 C ATOM 861 O PRO A 120 5.556 13.469 8.730 1.00 0.00 O ATOM 862 CB PRO A 120 4.381 13.171 11.523 1.00 0.00 C ATOM 863 CG PRO A 120 4.236 12.347 12.761 1.00 0.00 C ATOM 864 CD PRO A 120 4.821 11.010 12.431 1.00 0.00 C ATOM 0 HA PRO A 120 3.385 12.239 9.789 1.00 0.00 H new ATOM 0 HB2 PRO A 120 5.327 13.713 11.519 1.00 0.00 H new ATOM 0 HB3 PRO A 120 3.587 13.914 11.449 1.00 0.00 H new ATOM 0 HG2 PRO A 120 4.759 12.806 13.600 1.00 0.00 H new ATOM 0 HG3 PRO A 120 3.189 12.255 13.049 1.00 0.00 H new ATOM 0 HD2 PRO A 120 5.899 10.988 12.588 1.00 0.00 H new ATOM 0 HD3 PRO A 120 4.393 10.216 13.044 1.00 0.00 H new ATOM 872 N GLU A 121 6.298 11.395 9.223 1.00 0.00 N ATOM 873 CA GLU A 121 7.448 11.379 8.358 1.00 0.00 C ATOM 874 C GLU A 121 7.053 11.688 6.918 1.00 0.00 C ATOM 875 O GLU A 121 7.654 12.544 6.273 1.00 0.00 O ATOM 876 CB GLU A 121 8.069 9.979 8.430 1.00 0.00 C ATOM 877 CG GLU A 121 9.317 9.788 7.601 1.00 0.00 C ATOM 878 CD GLU A 121 10.423 10.708 8.022 1.00 0.00 C ATOM 879 OE1 GLU A 121 11.081 10.433 9.035 1.00 0.00 O ATOM 880 OE2 GLU A 121 10.642 11.734 7.355 1.00 0.00 O ATOM 0 H GLU A 121 6.183 10.523 9.739 1.00 0.00 H new ATOM 0 HA GLU A 121 8.159 12.140 8.680 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.305 9.756 9.471 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.324 9.251 8.110 1.00 0.00 H new ATOM 0 HG2 GLU A 121 9.654 8.755 7.687 1.00 0.00 H new ATOM 0 HG3 GLU A 121 9.083 9.961 6.550 1.00 0.00 H new ATOM 887 N LEU A 122 5.984 11.082 6.462 1.00 0.00 N ATOM 888 CA LEU A 122 5.570 11.272 5.091 1.00 0.00 C ATOM 889 C LEU A 122 4.365 12.173 5.000 1.00 0.00 C ATOM 890 O LEU A 122 3.748 12.282 3.956 1.00 0.00 O ATOM 891 CB LEU A 122 5.293 9.941 4.390 1.00 0.00 C ATOM 892 CG LEU A 122 6.467 8.969 4.242 1.00 0.00 C ATOM 893 CD1 LEU A 122 6.027 7.752 3.453 1.00 0.00 C ATOM 894 CD2 LEU A 122 7.656 9.636 3.559 1.00 0.00 C ATOM 0 H LEU A 122 5.390 10.460 7.011 1.00 0.00 H new ATOM 0 HA LEU A 122 6.400 11.755 4.576 1.00 0.00 H new ATOM 0 HB2 LEU A 122 4.499 9.431 4.936 1.00 0.00 H new ATOM 0 HB3 LEU A 122 4.907 10.158 3.394 1.00 0.00 H new ATOM 0 HG LEU A 122 6.784 8.661 5.239 1.00 0.00 H new ATOM 0 HD11 LEU A 122 6.865 7.063 3.350 1.00 0.00 H new ATOM 0 HD12 LEU A 122 5.211 7.255 3.977 1.00 0.00 H new ATOM 0 HD13 LEU A 122 5.689 8.062 2.464 1.00 0.00 H new ATOM 0 HD21 LEU A 122 8.473 8.920 3.469 1.00 0.00 H new ATOM 0 HD22 LEU A 122 7.361 9.977 2.567 1.00 0.00 H new ATOM 0 HD23 LEU A 122 7.985 10.489 4.153 1.00 0.00 H new ATOM 906 N CYS A 123 4.025 12.812 6.094 1.00 0.00 N ATOM 907 CA CYS A 123 2.916 13.748 6.084 1.00 0.00 C ATOM 908 C CYS A 123 3.228 14.994 5.248 1.00 0.00 C ATOM 909 O CYS A 123 3.939 15.905 5.684 1.00 0.00 O ATOM 910 CB CYS A 123 2.474 14.118 7.496 1.00 0.00 C ATOM 911 SG CYS A 123 1.799 12.723 8.418 1.00 0.00 S ATOM 0 H CYS A 123 4.491 12.706 6.995 1.00 0.00 H new ATOM 0 HA CYS A 123 2.078 13.241 5.606 1.00 0.00 H new ATOM 0 HB2 CYS A 123 3.325 14.527 8.040 1.00 0.00 H new ATOM 0 HB3 CYS A 123 1.723 14.906 7.440 1.00 0.00 H new ATOM 0 HG CYS A 123 1.607 13.073 9.655 1.00 0.00 H new ATOM 917 N GLY A 124 2.772 14.955 4.019 1.00 0.00 N ATOM 918 CA GLY A 124 2.867 16.067 3.121 1.00 0.00 C ATOM 919 C GLY A 124 1.618 16.138 2.287 1.00 0.00 C ATOM 920 O GLY A 124 0.834 17.077 2.394 1.00 0.00 O ATOM 0 H GLY A 124 2.319 14.135 3.615 1.00 0.00 H new ATOM 0 HA2 GLY A 124 2.997 16.993 3.682 1.00 0.00 H new ATOM 0 HA3 GLY A 124 3.741 15.958 2.479 1.00 0.00 H new ATOM 924 N SER A 125 1.404 15.121 1.502 1.00 0.00 N ATOM 925 CA SER A 125 0.232 15.009 0.683 1.00 0.00 C ATOM 926 C SER A 125 -0.043 13.543 0.369 1.00 0.00 C ATOM 927 O SER A 125 0.830 12.695 0.555 1.00 0.00 O ATOM 928 CB SER A 125 0.385 15.863 -0.585 1.00 0.00 C ATOM 929 OG SER A 125 1.632 15.627 -1.228 1.00 0.00 O ATOM 0 H SER A 125 2.048 14.335 1.412 1.00 0.00 H new ATOM 0 HA SER A 125 -0.633 15.394 1.223 1.00 0.00 H new ATOM 0 HB2 SER A 125 -0.429 15.640 -1.275 1.00 0.00 H new ATOM 0 HB3 SER A 125 0.303 16.918 -0.326 1.00 0.00 H new ATOM 0 HG SER A 125 1.696 16.184 -2.031 1.00 0.00 H new ATOM 935 N VAL A 126 -1.233 13.236 -0.048 1.00 0.00 N ATOM 936 CA VAL A 126 -1.595 11.874 -0.349 1.00 0.00 C ATOM 937 C VAL A 126 -2.492 11.834 -1.586 1.00 0.00 C ATOM 938 O VAL A 126 -3.337 12.692 -1.773 1.00 0.00 O ATOM 939 CB VAL A 126 -2.288 11.182 0.889 1.00 0.00 C ATOM 940 CG1 VAL A 126 -3.567 11.899 1.304 1.00 0.00 C ATOM 941 CG2 VAL A 126 -2.556 9.699 0.639 1.00 0.00 C ATOM 0 H VAL A 126 -1.981 13.914 -0.191 1.00 0.00 H new ATOM 0 HA VAL A 126 -0.687 11.311 -0.565 1.00 0.00 H new ATOM 0 HB VAL A 126 -1.583 11.258 1.717 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -4.009 11.388 2.159 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -3.335 12.929 1.577 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -4.273 11.894 0.473 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -3.033 9.263 1.516 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -3.212 9.588 -0.224 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -1.614 9.186 0.446 1.00 0.00 H new ATOM 951 N LYS A 127 -2.250 10.899 -2.444 1.00 0.00 N ATOM 952 CA LYS A 127 -3.070 10.691 -3.608 1.00 0.00 C ATOM 953 C LYS A 127 -3.865 9.434 -3.412 1.00 0.00 C ATOM 954 O LYS A 127 -3.361 8.475 -2.829 1.00 0.00 O ATOM 955 CB LYS A 127 -2.235 10.586 -4.887 1.00 0.00 C ATOM 956 CG LYS A 127 -1.590 11.881 -5.336 1.00 0.00 C ATOM 957 CD LYS A 127 -0.843 11.686 -6.636 1.00 0.00 C ATOM 958 CE LYS A 127 -0.170 12.953 -7.109 1.00 0.00 C ATOM 959 NZ LYS A 127 0.673 12.695 -8.294 1.00 0.00 N ATOM 0 H LYS A 127 -1.470 10.247 -2.362 1.00 0.00 H new ATOM 0 HA LYS A 127 -3.730 11.550 -3.726 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -1.453 9.842 -4.733 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -2.873 10.217 -5.690 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -2.354 12.648 -5.462 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -0.904 12.237 -4.567 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -0.093 10.906 -6.507 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -1.536 11.338 -7.402 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -0.925 13.701 -7.351 1.00 0.00 H new ATOM 0 HE3 LYS A 127 0.441 13.366 -6.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 1.015 13.598 -8.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 1.485 12.106 -8.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 0.113 12.199 -9.017 1.00 0.00 H new ATOM 973 N VAL A 128 -5.089 9.432 -3.856 1.00 0.00 N ATOM 974 CA VAL A 128 -5.945 8.271 -3.692 1.00 0.00 C ATOM 975 C VAL A 128 -6.588 7.882 -5.010 1.00 0.00 C ATOM 976 O VAL A 128 -7.016 8.745 -5.781 1.00 0.00 O ATOM 977 CB VAL A 128 -7.045 8.474 -2.601 1.00 0.00 C ATOM 978 CG1 VAL A 128 -6.426 8.682 -1.224 1.00 0.00 C ATOM 979 CG2 VAL A 128 -7.962 9.639 -2.953 1.00 0.00 C ATOM 0 H VAL A 128 -5.526 10.218 -4.337 1.00 0.00 H new ATOM 0 HA VAL A 128 -5.298 7.462 -3.351 1.00 0.00 H new ATOM 0 HB VAL A 128 -7.645 7.564 -2.571 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -7.217 8.820 -0.487 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -5.830 7.809 -0.957 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -5.788 9.565 -1.242 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -8.717 9.756 -2.175 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -7.375 10.554 -3.029 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -8.451 9.442 -3.907 1.00 0.00 H new ATOM 989 N GLY A 129 -6.623 6.608 -5.272 1.00 0.00 N ATOM 990 CA GLY A 129 -7.215 6.115 -6.468 1.00 0.00 C ATOM 991 C GLY A 129 -8.151 4.984 -6.168 1.00 0.00 C ATOM 992 O GLY A 129 -7.723 3.889 -5.774 1.00 0.00 O ATOM 0 H GLY A 129 -6.241 5.887 -4.660 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -7.755 6.918 -6.970 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -6.437 5.778 -7.153 1.00 0.00 H new ATOM 996 N ILE A 130 -9.410 5.233 -6.305 1.00 0.00 N ATOM 997 CA ILE A 130 -10.400 4.224 -6.068 1.00 0.00 C ATOM 998 C ILE A 130 -10.562 3.436 -7.342 1.00 0.00 C ATOM 999 O ILE A 130 -10.991 3.967 -8.363 1.00 0.00 O ATOM 1000 CB ILE A 130 -11.793 4.801 -5.598 1.00 0.00 C ATOM 1001 CG1 ILE A 130 -11.712 5.474 -4.204 1.00 0.00 C ATOM 1002 CG2 ILE A 130 -12.861 3.706 -5.573 1.00 0.00 C ATOM 1003 CD1 ILE A 130 -10.922 6.768 -4.142 1.00 0.00 C ATOM 0 H ILE A 130 -9.787 6.139 -6.584 1.00 0.00 H new ATOM 0 HA ILE A 130 -10.056 3.595 -5.247 1.00 0.00 H new ATOM 0 HB ILE A 130 -12.071 5.563 -6.326 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -12.726 5.672 -3.857 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -11.269 4.765 -3.504 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -13.810 4.131 -5.246 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -12.976 3.287 -6.573 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -12.559 2.919 -4.883 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -10.931 7.151 -3.122 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -9.893 6.581 -4.451 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -11.374 7.502 -4.809 1.00 0.00 H new ATOM 1015 N VAL A 131 -10.182 2.206 -7.304 1.00 0.00 N ATOM 1016 CA VAL A 131 -10.265 1.382 -8.463 1.00 0.00 C ATOM 1017 C VAL A 131 -11.495 0.490 -8.358 1.00 0.00 C ATOM 1018 O VAL A 131 -11.769 -0.092 -7.308 1.00 0.00 O ATOM 1019 CB VAL A 131 -8.939 0.576 -8.702 1.00 0.00 C ATOM 1020 CG1 VAL A 131 -8.589 -0.315 -7.529 1.00 0.00 C ATOM 1021 CG2 VAL A 131 -8.983 -0.216 -10.006 1.00 0.00 C ATOM 0 H VAL A 131 -9.807 1.744 -6.476 1.00 0.00 H new ATOM 0 HA VAL A 131 -10.380 2.011 -9.346 1.00 0.00 H new ATOM 0 HB VAL A 131 -8.142 1.314 -8.792 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -7.664 -0.851 -7.743 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -8.457 0.295 -6.635 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -9.394 -1.031 -7.363 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -8.047 -0.759 -10.133 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -9.812 -0.923 -9.974 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -9.122 0.468 -10.843 1.00 0.00 H new ATOM 1031 N GLU A 132 -12.258 0.444 -9.426 1.00 0.00 N ATOM 1032 CA GLU A 132 -13.509 -0.308 -9.477 1.00 0.00 C ATOM 1033 C GLU A 132 -13.244 -1.805 -9.440 1.00 0.00 C ATOM 1034 O GLU A 132 -14.084 -2.583 -8.987 1.00 0.00 O ATOM 1035 CB GLU A 132 -14.258 0.070 -10.735 1.00 0.00 C ATOM 1036 CG GLU A 132 -14.491 1.563 -10.843 1.00 0.00 C ATOM 1037 CD GLU A 132 -14.981 1.972 -12.189 1.00 0.00 C ATOM 1038 OE1 GLU A 132 -16.193 1.865 -12.453 1.00 0.00 O ATOM 1039 OE2 GLU A 132 -14.162 2.429 -13.009 1.00 0.00 O ATOM 0 H GLU A 132 -12.034 0.928 -10.295 1.00 0.00 H new ATOM 0 HA GLU A 132 -14.114 -0.060 -8.605 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -13.697 -0.271 -11.605 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -15.218 -0.447 -10.752 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -15.216 1.869 -10.089 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.562 2.089 -10.624 1.00 0.00 H new ATOM 1046 N GLU A 133 -12.079 -2.188 -9.921 1.00 0.00 N ATOM 1047 CA GLU A 133 -11.639 -3.563 -9.896 1.00 0.00 C ATOM 1048 C GLU A 133 -10.996 -3.814 -8.523 1.00 0.00 C ATOM 1049 O GLU A 133 -9.948 -3.253 -8.230 1.00 0.00 O ATOM 1050 CB GLU A 133 -10.604 -3.812 -11.014 1.00 0.00 C ATOM 1051 CG GLU A 133 -11.086 -3.497 -12.421 1.00 0.00 C ATOM 1052 CD GLU A 133 -10.017 -3.728 -13.479 1.00 0.00 C ATOM 1053 OE1 GLU A 133 -9.680 -4.878 -13.763 1.00 0.00 O ATOM 1054 OE2 GLU A 133 -9.547 -2.753 -14.101 1.00 0.00 O ATOM 0 H GLU A 133 -11.407 -1.547 -10.343 1.00 0.00 H new ATOM 0 HA GLU A 133 -12.480 -4.236 -10.059 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -9.718 -3.212 -10.807 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -10.297 -4.857 -10.977 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -11.955 -4.115 -12.649 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -11.413 -2.458 -12.463 1.00 0.00 H new ATOM 1061 N PRO A 134 -11.625 -4.619 -7.652 1.00 0.00 N ATOM 1062 CA PRO A 134 -11.130 -4.860 -6.300 1.00 0.00 C ATOM 1063 C PRO A 134 -10.311 -6.153 -6.166 1.00 0.00 C ATOM 1064 O PRO A 134 -10.104 -6.658 -5.057 1.00 0.00 O ATOM 1065 CB PRO A 134 -12.431 -4.971 -5.515 1.00 0.00 C ATOM 1066 CG PRO A 134 -13.414 -5.584 -6.473 1.00 0.00 C ATOM 1067 CD PRO A 134 -12.894 -5.325 -7.878 1.00 0.00 C ATOM 0 HA PRO A 134 -10.445 -4.082 -5.964 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -12.305 -5.592 -4.628 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -12.770 -3.993 -5.174 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -13.513 -6.654 -6.291 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -14.403 -5.146 -6.342 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -12.743 -6.254 -8.427 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -13.591 -4.721 -8.459 1.00 0.00 H new ATOM 1075 N ASP A 135 -9.834 -6.658 -7.273 1.00 0.00 N ATOM 1076 CA ASP A 135 -9.070 -7.898 -7.288 1.00 0.00 C ATOM 1077 C ASP A 135 -7.681 -7.657 -6.701 1.00 0.00 C ATOM 1078 O ASP A 135 -7.069 -6.625 -6.963 1.00 0.00 O ATOM 1079 CB ASP A 135 -8.960 -8.423 -8.719 1.00 0.00 C ATOM 1080 CG ASP A 135 -8.303 -9.784 -8.807 1.00 0.00 C ATOM 1081 OD1 ASP A 135 -7.058 -9.858 -8.821 1.00 0.00 O ATOM 1082 OD2 ASP A 135 -9.016 -10.802 -8.893 1.00 0.00 O ATOM 0 H ASP A 135 -9.958 -6.231 -8.191 1.00 0.00 H new ATOM 0 HA ASP A 135 -9.582 -8.644 -6.681 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -9.957 -8.479 -9.156 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -8.390 -7.712 -9.317 1.00 0.00 H new ATOM 1087 N LYS A 136 -7.185 -8.595 -5.918 1.00 0.00 N ATOM 1088 CA LYS A 136 -5.883 -8.452 -5.261 1.00 0.00 C ATOM 1089 C LYS A 136 -4.733 -8.225 -6.253 1.00 0.00 C ATOM 1090 O LYS A 136 -3.790 -7.469 -5.962 1.00 0.00 O ATOM 1091 CB LYS A 136 -5.584 -9.651 -4.360 1.00 0.00 C ATOM 1092 CG LYS A 136 -6.535 -9.815 -3.168 1.00 0.00 C ATOM 1093 CD LYS A 136 -6.430 -8.665 -2.156 1.00 0.00 C ATOM 1094 CE LYS A 136 -5.050 -8.596 -1.493 1.00 0.00 C ATOM 1095 NZ LYS A 136 -4.705 -9.844 -0.772 1.00 0.00 N ATOM 0 H LYS A 136 -7.662 -9.474 -5.715 1.00 0.00 H new ATOM 0 HA LYS A 136 -5.951 -7.556 -4.644 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -5.621 -10.558 -4.963 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -4.565 -9.559 -3.984 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -7.560 -9.878 -3.534 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -6.318 -10.757 -2.664 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -6.636 -7.721 -2.660 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -7.193 -8.789 -1.388 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -4.294 -8.399 -2.253 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -5.027 -7.759 -0.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -3.857 -9.686 -0.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -5.498 -10.122 -0.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -4.517 -10.601 -1.459 1.00 0.00 H new ATOM 1109 N ALA A 137 -4.828 -8.813 -7.433 1.00 0.00 N ATOM 1110 CA ALA A 137 -3.770 -8.671 -8.411 1.00 0.00 C ATOM 1111 C ALA A 137 -3.856 -7.325 -9.077 1.00 0.00 C ATOM 1112 O ALA A 137 -2.843 -6.680 -9.296 1.00 0.00 O ATOM 1113 CB ALA A 137 -3.803 -9.774 -9.449 1.00 0.00 C ATOM 0 H ALA A 137 -5.617 -9.386 -7.732 1.00 0.00 H new ATOM 0 HA ALA A 137 -2.821 -8.751 -7.881 1.00 0.00 H new ATOM 0 HB1 ALA A 137 -2.992 -9.627 -10.162 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -3.684 -10.740 -8.958 1.00 0.00 H new ATOM 0 HB3 ALA A 137 -4.757 -9.750 -9.975 1.00 0.00 H new ATOM 1119 N VAL A 138 -5.067 -6.870 -9.347 1.00 0.00 N ATOM 1120 CA VAL A 138 -5.254 -5.593 -10.026 1.00 0.00 C ATOM 1121 C VAL A 138 -4.894 -4.432 -9.087 1.00 0.00 C ATOM 1122 O VAL A 138 -4.389 -3.395 -9.533 1.00 0.00 O ATOM 1123 CB VAL A 138 -6.688 -5.414 -10.613 1.00 0.00 C ATOM 1124 CG1 VAL A 138 -7.083 -6.596 -11.470 1.00 0.00 C ATOM 1125 CG2 VAL A 138 -7.709 -5.155 -9.541 1.00 0.00 C ATOM 0 H VAL A 138 -5.931 -7.358 -9.110 1.00 0.00 H new ATOM 0 HA VAL A 138 -4.576 -5.587 -10.879 1.00 0.00 H new ATOM 0 HB VAL A 138 -6.662 -4.531 -11.251 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -8.087 -6.440 -11.864 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -6.380 -6.697 -12.297 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -7.066 -7.504 -10.867 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -8.692 -5.037 -9.996 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -7.729 -5.995 -8.847 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -7.447 -4.245 -9.001 1.00 0.00 H new ATOM 1135 N LEU A 139 -5.129 -4.629 -7.780 1.00 0.00 N ATOM 1136 CA LEU A 139 -4.733 -3.653 -6.771 1.00 0.00 C ATOM 1137 C LEU A 139 -3.225 -3.512 -6.795 1.00 0.00 C ATOM 1138 O LEU A 139 -2.689 -2.409 -6.840 1.00 0.00 O ATOM 1139 CB LEU A 139 -5.180 -4.092 -5.358 1.00 0.00 C ATOM 1140 CG LEU A 139 -6.688 -4.217 -5.099 1.00 0.00 C ATOM 1141 CD1 LEU A 139 -6.941 -4.721 -3.689 1.00 0.00 C ATOM 1142 CD2 LEU A 139 -7.386 -2.887 -5.308 1.00 0.00 C ATOM 0 H LEU A 139 -5.591 -5.457 -7.405 1.00 0.00 H new ATOM 0 HA LEU A 139 -5.214 -2.702 -6.999 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -4.721 -5.057 -5.145 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -4.773 -3.380 -4.640 1.00 0.00 H new ATOM 0 HG LEU A 139 -7.095 -4.935 -5.811 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -8.015 -4.805 -3.520 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -6.477 -5.699 -3.563 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -6.514 -4.022 -2.970 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -8.453 -3.002 -5.118 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -6.973 -2.148 -4.622 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -7.234 -2.554 -6.335 1.00 0.00 H new ATOM 1154 N THR A 140 -2.557 -4.650 -6.831 1.00 0.00 N ATOM 1155 CA THR A 140 -1.117 -4.701 -6.853 1.00 0.00 C ATOM 1156 C THR A 140 -0.579 -4.178 -8.205 1.00 0.00 C ATOM 1157 O THR A 140 0.485 -3.591 -8.269 1.00 0.00 O ATOM 1158 CB THR A 140 -0.638 -6.149 -6.594 1.00 0.00 C ATOM 1159 OG1 THR A 140 -1.276 -6.644 -5.388 1.00 0.00 O ATOM 1160 CG2 THR A 140 0.876 -6.206 -6.416 1.00 0.00 C ATOM 0 H THR A 140 -3.005 -5.566 -6.846 1.00 0.00 H new ATOM 0 HA THR A 140 -0.727 -4.059 -6.063 1.00 0.00 H new ATOM 0 HB THR A 140 -0.906 -6.763 -7.454 1.00 0.00 H new ATOM 0 HG1 THR A 140 -2.127 -7.071 -5.620 1.00 0.00 H new ATOM 0 HG21 THR A 140 1.183 -7.236 -6.236 1.00 0.00 H new ATOM 0 HG22 THR A 140 1.363 -5.835 -7.318 1.00 0.00 H new ATOM 0 HG23 THR A 140 1.166 -5.587 -5.567 1.00 0.00 H new ATOM 1168 N GLN A 141 -1.352 -4.370 -9.262 1.00 0.00 N ATOM 1169 CA GLN A 141 -0.995 -3.914 -10.585 1.00 0.00 C ATOM 1170 C GLN A 141 -0.979 -2.392 -10.646 1.00 0.00 C ATOM 1171 O GLN A 141 -0.029 -1.801 -11.149 1.00 0.00 O ATOM 1172 CB GLN A 141 -1.965 -4.481 -11.606 1.00 0.00 C ATOM 1173 CG GLN A 141 -1.652 -4.096 -13.025 1.00 0.00 C ATOM 1174 CD GLN A 141 -2.594 -4.734 -14.003 1.00 0.00 C ATOM 1175 OE1 GLN A 141 -2.333 -5.833 -14.506 1.00 0.00 O ATOM 1176 NE2 GLN A 141 -3.687 -4.080 -14.269 1.00 0.00 N ATOM 0 H GLN A 141 -2.251 -4.851 -9.220 1.00 0.00 H new ATOM 0 HA GLN A 141 0.009 -4.269 -10.818 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -1.966 -5.568 -11.527 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -2.972 -4.143 -11.362 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -1.704 -3.012 -13.126 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -0.630 -4.389 -13.263 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -3.860 -3.176 -13.830 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -4.371 -4.472 -14.917 1.00 0.00 H new ATOM 1185 N ALA A 142 -2.026 -1.767 -10.123 1.00 0.00 N ATOM 1186 CA ALA A 142 -2.094 -0.315 -10.073 1.00 0.00 C ATOM 1187 C ALA A 142 -0.977 0.204 -9.172 1.00 0.00 C ATOM 1188 O ALA A 142 -0.248 1.113 -9.542 1.00 0.00 O ATOM 1189 CB ALA A 142 -3.459 0.137 -9.579 1.00 0.00 C ATOM 0 H ALA A 142 -2.837 -2.243 -9.729 1.00 0.00 H new ATOM 0 HA ALA A 142 -1.959 0.095 -11.074 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -3.492 1.226 -9.548 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -4.231 -0.230 -10.255 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -3.634 -0.260 -8.579 1.00 0.00 H new ATOM 1195 N TRP A 143 -0.829 -0.448 -8.020 1.00 0.00 N ATOM 1196 CA TRP A 143 0.231 -0.179 -7.044 1.00 0.00 C ATOM 1197 C TRP A 143 1.607 -0.176 -7.745 1.00 0.00 C ATOM 1198 O TRP A 143 2.434 0.723 -7.542 1.00 0.00 O ATOM 1199 CB TRP A 143 0.162 -1.299 -5.977 1.00 0.00 C ATOM 1200 CG TRP A 143 1.226 -1.298 -4.925 1.00 0.00 C ATOM 1201 CD1 TRP A 143 1.184 -0.679 -3.719 1.00 0.00 C ATOM 1202 CD2 TRP A 143 2.479 -1.997 -4.980 1.00 0.00 C ATOM 1203 NE1 TRP A 143 2.344 -0.916 -3.026 1.00 0.00 N ATOM 1204 CE2 TRP A 143 3.159 -1.727 -3.785 1.00 0.00 C ATOM 1205 CE3 TRP A 143 3.092 -2.811 -5.939 1.00 0.00 C ATOM 1206 CZ2 TRP A 143 4.429 -2.252 -3.520 1.00 0.00 C ATOM 1207 CZ3 TRP A 143 4.340 -3.328 -5.677 1.00 0.00 C ATOM 1208 CH2 TRP A 143 4.998 -3.045 -4.477 1.00 0.00 C ATOM 0 H TRP A 143 -1.458 -1.197 -7.730 1.00 0.00 H new ATOM 0 HA TRP A 143 0.098 0.798 -6.579 1.00 0.00 H new ATOM 0 HB2 TRP A 143 -0.806 -1.235 -5.480 1.00 0.00 H new ATOM 0 HB3 TRP A 143 0.194 -2.260 -6.491 1.00 0.00 H new ATOM 0 HD1 TRP A 143 0.357 -0.086 -3.357 1.00 0.00 H new ATOM 0 HE1 TRP A 143 2.567 -0.551 -2.100 1.00 0.00 H new ATOM 0 HE3 TRP A 143 2.593 -3.030 -6.871 1.00 0.00 H new ATOM 0 HZ2 TRP A 143 4.941 -2.038 -2.593 1.00 0.00 H new ATOM 0 HZ3 TRP A 143 4.818 -3.962 -6.409 1.00 0.00 H new ATOM 0 HH2 TRP A 143 5.979 -3.462 -4.302 1.00 0.00 H new ATOM 1219 N LYS A 144 1.802 -1.178 -8.584 1.00 0.00 N ATOM 1220 CA LYS A 144 3.013 -1.384 -9.355 1.00 0.00 C ATOM 1221 C LYS A 144 3.281 -0.207 -10.294 1.00 0.00 C ATOM 1222 O LYS A 144 4.386 0.321 -10.335 1.00 0.00 O ATOM 1223 CB LYS A 144 2.874 -2.679 -10.163 1.00 0.00 C ATOM 1224 CG LYS A 144 4.068 -3.043 -11.014 1.00 0.00 C ATOM 1225 CD LYS A 144 3.781 -4.276 -11.848 1.00 0.00 C ATOM 1226 CE LYS A 144 4.976 -4.647 -12.701 1.00 0.00 C ATOM 1227 NZ LYS A 144 4.707 -5.801 -13.570 1.00 0.00 N ATOM 0 H LYS A 144 1.096 -1.895 -8.752 1.00 0.00 H new ATOM 0 HA LYS A 144 3.857 -1.459 -8.669 1.00 0.00 H new ATOM 0 HB2 LYS A 144 2.678 -3.499 -9.472 1.00 0.00 H new ATOM 0 HB3 LYS A 144 2.001 -2.592 -10.810 1.00 0.00 H new ATOM 0 HG2 LYS A 144 4.322 -2.208 -11.667 1.00 0.00 H new ATOM 0 HG3 LYS A 144 4.933 -3.224 -10.376 1.00 0.00 H new ATOM 0 HD2 LYS A 144 3.524 -5.109 -11.194 1.00 0.00 H new ATOM 0 HD3 LYS A 144 2.917 -4.094 -12.487 1.00 0.00 H new ATOM 0 HE2 LYS A 144 5.261 -3.792 -13.314 1.00 0.00 H new ATOM 0 HE3 LYS A 144 5.824 -4.872 -12.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 5.554 -6.016 -14.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 4.461 -6.626 -12.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 3.915 -5.579 -14.206 1.00 0.00 H new ATOM 1241 N LEU A 145 2.265 0.206 -11.022 1.00 0.00 N ATOM 1242 CA LEU A 145 2.395 1.293 -11.985 1.00 0.00 C ATOM 1243 C LEU A 145 2.743 2.599 -11.275 1.00 0.00 C ATOM 1244 O LEU A 145 3.617 3.362 -11.724 1.00 0.00 O ATOM 1245 CB LEU A 145 1.096 1.445 -12.785 1.00 0.00 C ATOM 1246 CG LEU A 145 0.604 0.183 -13.509 1.00 0.00 C ATOM 1247 CD1 LEU A 145 -0.676 0.457 -14.277 1.00 0.00 C ATOM 1248 CD2 LEU A 145 1.680 -0.377 -14.429 1.00 0.00 C ATOM 0 H LEU A 145 1.329 -0.196 -10.968 1.00 0.00 H new ATOM 0 HA LEU A 145 3.204 1.054 -12.675 1.00 0.00 H new ATOM 0 HB2 LEU A 145 0.311 1.781 -12.107 1.00 0.00 H new ATOM 0 HB3 LEU A 145 1.237 2.233 -13.525 1.00 0.00 H new ATOM 0 HG LEU A 145 0.386 -0.569 -12.751 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -1.001 -0.454 -14.780 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -1.452 0.786 -13.586 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -0.496 1.236 -15.018 1.00 0.00 H new ATOM 0 HD21 LEU A 145 1.303 -1.270 -14.928 1.00 0.00 H new ATOM 0 HD22 LEU A 145 1.946 0.371 -15.176 1.00 0.00 H new ATOM 0 HD23 LEU A 145 2.562 -0.634 -13.843 1.00 0.00 H new ATOM 1260 N TRP A 146 2.092 2.810 -10.157 1.00 0.00 N ATOM 1261 CA TRP A 146 2.278 3.978 -9.326 1.00 0.00 C ATOM 1262 C TRP A 146 3.708 4.073 -8.782 1.00 0.00 C ATOM 1263 O TRP A 146 4.381 5.127 -8.914 1.00 0.00 O ATOM 1264 CB TRP A 146 1.259 3.955 -8.185 1.00 0.00 C ATOM 1265 CG TRP A 146 -0.153 4.256 -8.614 1.00 0.00 C ATOM 1266 CD1 TRP A 146 -0.706 4.097 -9.859 1.00 0.00 C ATOM 1267 CD2 TRP A 146 -1.185 4.773 -7.788 1.00 0.00 C ATOM 1268 NE1 TRP A 146 -2.008 4.497 -9.849 1.00 0.00 N ATOM 1269 CE2 TRP A 146 -2.329 4.924 -8.589 1.00 0.00 C ATOM 1270 CE3 TRP A 146 -1.250 5.132 -6.445 1.00 0.00 C ATOM 1271 CZ2 TRP A 146 -3.517 5.421 -8.087 1.00 0.00 C ATOM 1272 CZ3 TRP A 146 -2.431 5.626 -5.949 1.00 0.00 C ATOM 1273 CH2 TRP A 146 -3.548 5.770 -6.764 1.00 0.00 C ATOM 0 H TRP A 146 1.400 2.158 -9.789 1.00 0.00 H new ATOM 0 HA TRP A 146 2.117 4.865 -9.939 1.00 0.00 H new ATOM 0 HB2 TRP A 146 1.282 2.973 -7.712 1.00 0.00 H new ATOM 0 HB3 TRP A 146 1.560 4.680 -7.429 1.00 0.00 H new ATOM 0 HD1 TRP A 146 -0.185 3.711 -10.722 1.00 0.00 H new ATOM 0 HE1 TRP A 146 -2.640 4.481 -10.649 1.00 0.00 H new ATOM 0 HE3 TRP A 146 -0.387 5.024 -5.805 1.00 0.00 H new ATOM 0 HZ2 TRP A 146 -4.389 5.530 -8.715 1.00 0.00 H new ATOM 0 HZ3 TRP A 146 -2.493 5.907 -4.908 1.00 0.00 H new ATOM 0 HH2 TRP A 146 -4.461 6.166 -6.344 1.00 0.00 H new ATOM 1284 N ILE A 147 4.192 2.991 -8.194 1.00 0.00 N ATOM 1285 CA ILE A 147 5.536 3.002 -7.653 1.00 0.00 C ATOM 1286 C ILE A 147 6.564 3.125 -8.785 1.00 0.00 C ATOM 1287 O ILE A 147 7.499 3.925 -8.693 1.00 0.00 O ATOM 1288 CB ILE A 147 5.848 1.777 -6.709 1.00 0.00 C ATOM 1289 CG1 ILE A 147 7.254 1.902 -6.094 1.00 0.00 C ATOM 1290 CG2 ILE A 147 5.687 0.438 -7.420 1.00 0.00 C ATOM 1291 CD1 ILE A 147 7.611 0.800 -5.119 1.00 0.00 C ATOM 0 H ILE A 147 3.685 2.113 -8.082 1.00 0.00 H new ATOM 0 HA ILE A 147 5.611 3.881 -7.013 1.00 0.00 H new ATOM 0 HB ILE A 147 5.112 1.802 -5.906 1.00 0.00 H new ATOM 0 HG12 ILE A 147 7.990 1.911 -6.898 1.00 0.00 H new ATOM 0 HG13 ILE A 147 7.329 2.862 -5.582 1.00 0.00 H new ATOM 0 HG21 ILE A 147 5.913 -0.372 -6.726 1.00 0.00 H new ATOM 0 HG22 ILE A 147 4.662 0.336 -7.775 1.00 0.00 H new ATOM 0 HG23 ILE A 147 6.371 0.392 -8.268 1.00 0.00 H new ATOM 0 HD11 ILE A 147 8.617 0.966 -4.734 1.00 0.00 H new ATOM 0 HD12 ILE A 147 6.901 0.802 -4.292 1.00 0.00 H new ATOM 0 HD13 ILE A 147 7.572 -0.163 -5.628 1.00 0.00 H new ATOM 1303 N GLU A 148 6.325 2.418 -9.889 1.00 0.00 N ATOM 1304 CA GLU A 148 7.246 2.422 -11.007 1.00 0.00 C ATOM 1305 C GLU A 148 7.381 3.765 -11.698 1.00 0.00 C ATOM 1306 O GLU A 148 8.486 4.095 -12.157 1.00 0.00 O ATOM 1307 CB GLU A 148 6.983 1.311 -12.004 1.00 0.00 C ATOM 1308 CG GLU A 148 7.349 -0.073 -11.491 1.00 0.00 C ATOM 1309 CD GLU A 148 7.181 -1.136 -12.541 1.00 0.00 C ATOM 1310 OE1 GLU A 148 7.270 -0.819 -13.754 1.00 0.00 O ATOM 1311 OE2 GLU A 148 7.013 -2.310 -12.192 1.00 0.00 O ATOM 0 H GLU A 148 5.498 1.837 -10.026 1.00 0.00 H new ATOM 0 HA GLU A 148 8.214 2.221 -10.548 1.00 0.00 H new ATOM 0 HB2 GLU A 148 5.927 1.321 -12.274 1.00 0.00 H new ATOM 0 HB3 GLU A 148 7.547 1.512 -12.915 1.00 0.00 H new ATOM 0 HG2 GLU A 148 8.383 -0.068 -11.145 1.00 0.00 H new ATOM 0 HG3 GLU A 148 6.726 -0.315 -10.630 1.00 0.00 H new ATOM 1318 N GLU A 149 6.293 4.570 -11.783 1.00 0.00 N ATOM 1319 CA GLU A 149 6.458 5.899 -12.374 1.00 0.00 C ATOM 1320 C GLU A 149 7.407 6.711 -11.518 1.00 0.00 C ATOM 1321 O GLU A 149 8.259 7.424 -12.021 1.00 0.00 O ATOM 1322 CB GLU A 149 5.144 6.688 -12.651 1.00 0.00 C ATOM 1323 CG GLU A 149 4.299 7.019 -11.436 1.00 0.00 C ATOM 1324 CD GLU A 149 3.465 8.278 -11.623 1.00 0.00 C ATOM 1325 OE1 GLU A 149 2.459 8.260 -12.357 1.00 0.00 O ATOM 1326 OE2 GLU A 149 3.795 9.313 -11.000 1.00 0.00 O ATOM 0 H GLU A 149 5.352 4.334 -11.468 1.00 0.00 H new ATOM 0 HA GLU A 149 6.872 5.729 -13.368 1.00 0.00 H new ATOM 0 HB2 GLU A 149 5.402 7.620 -13.154 1.00 0.00 H new ATOM 0 HB3 GLU A 149 4.535 6.109 -13.345 1.00 0.00 H new ATOM 0 HG2 GLU A 149 3.638 6.180 -11.219 1.00 0.00 H new ATOM 0 HG3 GLU A 149 4.949 7.145 -10.570 1.00 0.00 H new ATOM 1333 N HIS A 150 7.316 6.541 -10.215 1.00 0.00 N ATOM 1334 CA HIS A 150 8.223 7.244 -9.349 1.00 0.00 C ATOM 1335 C HIS A 150 9.622 6.693 -9.359 1.00 0.00 C ATOM 1336 O HIS A 150 10.579 7.451 -9.230 1.00 0.00 O ATOM 1337 CB HIS A 150 7.670 7.492 -7.970 1.00 0.00 C ATOM 1338 CG HIS A 150 6.666 8.582 -8.021 1.00 0.00 C ATOM 1339 ND1 HIS A 150 6.974 9.898 -7.794 1.00 0.00 N ATOM 1340 CD2 HIS A 150 5.375 8.561 -8.374 1.00 0.00 C ATOM 1341 CE1 HIS A 150 5.919 10.634 -8.013 1.00 0.00 C ATOM 1342 NE2 HIS A 150 4.923 9.850 -8.371 1.00 0.00 N ATOM 0 H HIS A 150 6.640 5.937 -9.747 1.00 0.00 H new ATOM 0 HA HIS A 150 8.320 8.236 -9.789 1.00 0.00 H new ATOM 0 HB2 HIS A 150 7.213 6.582 -7.582 1.00 0.00 H new ATOM 0 HB3 HIS A 150 8.477 7.759 -7.287 1.00 0.00 H new ATOM 0 HD1 HIS A 150 7.886 10.248 -7.500 1.00 0.00 H new ATOM 0 HD2 HIS A 150 4.795 7.683 -8.617 1.00 0.00 H new ATOM 0 HE1 HIS A 150 5.870 11.709 -7.917 1.00 0.00 H new ATOM 1351 N ILE A 151 9.756 5.407 -9.555 1.00 0.00 N ATOM 1352 CA ILE A 151 11.070 4.790 -9.691 1.00 0.00 C ATOM 1353 C ILE A 151 11.811 5.370 -10.914 1.00 0.00 C ATOM 1354 O ILE A 151 13.001 5.644 -10.846 1.00 0.00 O ATOM 1355 CB ILE A 151 10.997 3.230 -9.798 1.00 0.00 C ATOM 1356 CG1 ILE A 151 10.355 2.638 -8.535 1.00 0.00 C ATOM 1357 CG2 ILE A 151 12.396 2.633 -10.007 1.00 0.00 C ATOM 1358 CD1 ILE A 151 10.197 1.129 -8.562 1.00 0.00 C ATOM 0 H ILE A 151 8.974 4.756 -9.626 1.00 0.00 H new ATOM 0 HA ILE A 151 11.624 5.024 -8.782 1.00 0.00 H new ATOM 0 HB ILE A 151 10.380 2.976 -10.660 1.00 0.00 H new ATOM 0 HG12 ILE A 151 10.961 2.913 -7.671 1.00 0.00 H new ATOM 0 HG13 ILE A 151 9.374 3.092 -8.394 1.00 0.00 H new ATOM 0 HG21 ILE A 151 12.322 1.548 -10.079 1.00 0.00 H new ATOM 0 HG22 ILE A 151 12.827 3.029 -10.927 1.00 0.00 H new ATOM 0 HG23 ILE A 151 13.034 2.898 -9.164 1.00 0.00 H new ATOM 0 HD11 ILE A 151 9.736 0.795 -7.633 1.00 0.00 H new ATOM 0 HD12 ILE A 151 9.565 0.844 -9.403 1.00 0.00 H new ATOM 0 HD13 ILE A 151 11.176 0.663 -8.670 1.00 0.00 H new ATOM 1370 N LYS A 152 11.094 5.624 -11.996 1.00 0.00 N ATOM 1371 CA LYS A 152 11.740 6.141 -13.198 1.00 0.00 C ATOM 1372 C LYS A 152 11.958 7.670 -13.189 1.00 0.00 C ATOM 1373 O LYS A 152 12.795 8.173 -13.933 1.00 0.00 O ATOM 1374 CB LYS A 152 11.037 5.671 -14.485 1.00 0.00 C ATOM 1375 CG LYS A 152 9.563 6.003 -14.571 1.00 0.00 C ATOM 1376 CD LYS A 152 8.962 5.524 -15.881 1.00 0.00 C ATOM 1377 CE LYS A 152 7.456 5.745 -15.927 1.00 0.00 C ATOM 1378 NZ LYS A 152 6.875 5.312 -17.203 1.00 0.00 N ATOM 0 H LYS A 152 10.086 5.486 -12.071 1.00 0.00 H new ATOM 0 HA LYS A 152 12.739 5.705 -13.190 1.00 0.00 H new ATOM 0 HB2 LYS A 152 11.544 6.117 -15.341 1.00 0.00 H new ATOM 0 HB3 LYS A 152 11.156 4.591 -14.571 1.00 0.00 H new ATOM 0 HG2 LYS A 152 9.035 5.541 -13.737 1.00 0.00 H new ATOM 0 HG3 LYS A 152 9.425 7.080 -14.478 1.00 0.00 H new ATOM 0 HD2 LYS A 152 9.432 6.051 -16.711 1.00 0.00 H new ATOM 0 HD3 LYS A 152 9.178 4.464 -16.014 1.00 0.00 H new ATOM 0 HE2 LYS A 152 6.984 5.199 -15.110 1.00 0.00 H new ATOM 0 HE3 LYS A 152 7.240 6.802 -15.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 5.849 5.480 -17.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 7.306 5.851 -17.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 7.058 4.298 -17.341 1.00 0.00 H new ATOM 1392 N VAL A 153 11.211 8.404 -12.375 1.00 0.00 N ATOM 1393 CA VAL A 153 11.391 9.864 -12.332 1.00 0.00 C ATOM 1394 C VAL A 153 12.214 10.347 -11.101 1.00 0.00 C ATOM 1395 O VAL A 153 13.070 11.227 -11.225 1.00 0.00 O ATOM 1396 CB VAL A 153 10.033 10.639 -12.445 1.00 0.00 C ATOM 1397 CG1 VAL A 153 9.104 10.338 -11.293 1.00 0.00 C ATOM 1398 CG2 VAL A 153 10.244 12.137 -12.590 1.00 0.00 C ATOM 0 H VAL A 153 10.494 8.035 -11.750 1.00 0.00 H new ATOM 0 HA VAL A 153 11.981 10.105 -13.216 1.00 0.00 H new ATOM 0 HB VAL A 153 9.553 10.280 -13.355 1.00 0.00 H new ATOM 0 HG11 VAL A 153 8.177 10.898 -11.417 1.00 0.00 H new ATOM 0 HG12 VAL A 153 8.883 9.271 -11.273 1.00 0.00 H new ATOM 0 HG13 VAL A 153 9.580 10.627 -10.356 1.00 0.00 H new ATOM 0 HG21 VAL A 153 9.277 12.635 -12.665 1.00 0.00 H new ATOM 0 HG22 VAL A 153 10.780 12.515 -11.719 1.00 0.00 H new ATOM 0 HG23 VAL A 153 10.826 12.337 -13.490 1.00 0.00 H new ATOM 1408 N THR A 154 11.971 9.777 -9.931 1.00 0.00 N ATOM 1409 CA THR A 154 12.692 10.195 -8.737 1.00 0.00 C ATOM 1410 C THR A 154 13.618 9.080 -8.210 1.00 0.00 C ATOM 1411 O THR A 154 14.565 9.340 -7.468 1.00 0.00 O ATOM 1412 CB THR A 154 11.739 10.787 -7.613 1.00 0.00 C ATOM 1413 OG1 THR A 154 12.460 11.058 -6.405 1.00 0.00 O ATOM 1414 CG2 THR A 154 10.548 9.883 -7.308 1.00 0.00 C ATOM 0 H THR A 154 11.289 9.033 -9.782 1.00 0.00 H new ATOM 0 HA THR A 154 13.335 11.023 -9.035 1.00 0.00 H new ATOM 0 HB THR A 154 11.350 11.722 -8.017 1.00 0.00 H new ATOM 0 HG1 THR A 154 11.832 11.330 -5.703 1.00 0.00 H new ATOM 0 HG21 THR A 154 9.933 10.340 -6.533 1.00 0.00 H new ATOM 0 HG22 THR A 154 9.952 9.749 -8.211 1.00 0.00 H new ATOM 0 HG23 THR A 154 10.906 8.913 -6.962 1.00 0.00 H new ATOM 1422 N GLY A 155 13.354 7.847 -8.618 1.00 0.00 N ATOM 1423 CA GLY A 155 14.205 6.733 -8.222 1.00 0.00 C ATOM 1424 C GLY A 155 13.829 6.172 -6.873 1.00 0.00 C ATOM 1425 O GLY A 155 14.534 5.313 -6.325 1.00 0.00 O ATOM 0 H GLY A 155 12.567 7.594 -9.216 1.00 0.00 H new ATOM 0 HA2 GLY A 155 14.138 5.944 -8.972 1.00 0.00 H new ATOM 0 HA3 GLY A 155 15.243 7.063 -8.198 1.00 0.00 H new ATOM 1429 N LYS A 156 12.715 6.634 -6.351 1.00 0.00 N ATOM 1430 CA LYS A 156 12.271 6.232 -5.041 1.00 0.00 C ATOM 1431 C LYS A 156 11.656 4.856 -5.005 1.00 0.00 C ATOM 1432 O LYS A 156 10.770 4.519 -5.789 1.00 0.00 O ATOM 1433 CB LYS A 156 11.347 7.263 -4.383 1.00 0.00 C ATOM 1434 CG LYS A 156 12.052 8.506 -3.843 1.00 0.00 C ATOM 1435 CD LYS A 156 13.094 8.129 -2.789 1.00 0.00 C ATOM 1436 CE LYS A 156 13.682 9.338 -2.081 1.00 0.00 C ATOM 1437 NZ LYS A 156 14.275 10.311 -3.015 1.00 0.00 N ATOM 0 H LYS A 156 12.097 7.295 -6.821 1.00 0.00 H new ATOM 0 HA LYS A 156 13.184 6.181 -4.448 1.00 0.00 H new ATOM 0 HB2 LYS A 156 10.598 7.575 -5.111 1.00 0.00 H new ATOM 0 HB3 LYS A 156 10.814 6.781 -3.564 1.00 0.00 H new ATOM 0 HG2 LYS A 156 12.534 9.040 -4.662 1.00 0.00 H new ATOM 0 HG3 LYS A 156 11.318 9.185 -3.408 1.00 0.00 H new ATOM 0 HD2 LYS A 156 12.636 7.470 -2.052 1.00 0.00 H new ATOM 0 HD3 LYS A 156 13.897 7.566 -3.264 1.00 0.00 H new ATOM 0 HE2 LYS A 156 12.902 9.828 -1.499 1.00 0.00 H new ATOM 0 HE3 LYS A 156 14.444 9.006 -1.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 15.003 10.867 -2.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 14.708 9.806 -3.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 13.534 10.948 -3.369 1.00 0.00 H new ATOM 1451 N VAL A 157 12.172 4.090 -4.096 1.00 0.00 N ATOM 1452 CA VAL A 157 11.724 2.778 -3.747 1.00 0.00 C ATOM 1453 C VAL A 157 12.247 2.494 -2.313 1.00 0.00 C ATOM 1454 O VAL A 157 13.305 1.907 -2.111 1.00 0.00 O ATOM 1455 CB VAL A 157 12.137 1.674 -4.806 1.00 0.00 C ATOM 1456 CG1 VAL A 157 13.639 1.657 -5.099 1.00 0.00 C ATOM 1457 CG2 VAL A 157 11.649 0.289 -4.387 1.00 0.00 C ATOM 0 H VAL A 157 12.974 4.386 -3.539 1.00 0.00 H new ATOM 0 HA VAL A 157 10.635 2.732 -3.760 1.00 0.00 H new ATOM 0 HB VAL A 157 11.640 1.948 -5.737 1.00 0.00 H new ATOM 0 HG11 VAL A 157 13.858 0.880 -5.831 1.00 0.00 H new ATOM 0 HG12 VAL A 157 13.943 2.626 -5.496 1.00 0.00 H new ATOM 0 HG13 VAL A 157 14.187 1.453 -4.179 1.00 0.00 H new ATOM 0 HG21 VAL A 157 11.949 -0.444 -5.135 1.00 0.00 H new ATOM 0 HG22 VAL A 157 12.087 0.025 -3.424 1.00 0.00 H new ATOM 0 HG23 VAL A 157 10.562 0.296 -4.302 1.00 0.00 H new ATOM 1467 N PRO A 158 11.575 3.079 -1.309 1.00 0.00 N ATOM 1468 CA PRO A 158 11.978 3.003 0.100 1.00 0.00 C ATOM 1469 C PRO A 158 11.503 1.716 0.820 1.00 0.00 C ATOM 1470 O PRO A 158 10.645 0.976 0.303 1.00 0.00 O ATOM 1471 CB PRO A 158 11.296 4.258 0.716 1.00 0.00 C ATOM 1472 CG PRO A 158 10.705 4.983 -0.443 1.00 0.00 C ATOM 1473 CD PRO A 158 10.398 3.927 -1.448 1.00 0.00 C ATOM 0 HA PRO A 158 13.062 2.973 0.206 1.00 0.00 H new ATOM 0 HB2 PRO A 158 10.529 3.976 1.438 1.00 0.00 H new ATOM 0 HB3 PRO A 158 12.018 4.880 1.244 1.00 0.00 H new ATOM 0 HG2 PRO A 158 9.804 5.523 -0.152 1.00 0.00 H new ATOM 0 HG3 PRO A 158 11.402 5.718 -0.845 1.00 0.00 H new ATOM 0 HD2 PRO A 158 9.474 3.395 -1.221 1.00 0.00 H new ATOM 0 HD3 PRO A 158 10.294 4.331 -2.455 1.00 0.00 H new ATOM 1481 N PRO A 159 12.057 1.448 2.050 1.00 0.00 N ATOM 1482 CA PRO A 159 11.734 0.264 2.899 1.00 0.00 C ATOM 1483 C PRO A 159 10.244 0.061 3.210 1.00 0.00 C ATOM 1484 O PRO A 159 9.864 -0.966 3.763 1.00 0.00 O ATOM 1485 CB PRO A 159 12.499 0.517 4.202 1.00 0.00 C ATOM 1486 CG PRO A 159 12.893 1.946 4.148 1.00 0.00 C ATOM 1487 CD PRO A 159 13.096 2.264 2.705 1.00 0.00 C ATOM 0 HA PRO A 159 12.014 -0.645 2.366 1.00 0.00 H new ATOM 0 HB2 PRO A 159 11.874 0.313 5.072 1.00 0.00 H new ATOM 0 HB3 PRO A 159 13.373 -0.130 4.278 1.00 0.00 H new ATOM 0 HG2 PRO A 159 12.120 2.580 4.582 1.00 0.00 H new ATOM 0 HG3 PRO A 159 13.806 2.121 4.718 1.00 0.00 H new ATOM 0 HD2 PRO A 159 12.966 3.327 2.501 1.00 0.00 H new ATOM 0 HD3 PRO A 159 14.097 1.995 2.367 1.00 0.00 H new ATOM 1495 N GLY A 160 9.439 1.074 2.951 1.00 0.00 N ATOM 1496 CA GLY A 160 8.008 0.948 3.125 1.00 0.00 C ATOM 1497 C GLY A 160 7.403 0.049 2.072 1.00 0.00 C ATOM 1498 O GLY A 160 6.560 -0.794 2.369 1.00 0.00 O ATOM 0 H GLY A 160 9.751 1.987 2.621 1.00 0.00 H new ATOM 0 HA2 GLY A 160 7.794 0.546 4.115 1.00 0.00 H new ATOM 0 HA3 GLY A 160 7.545 1.934 3.074 1.00 0.00 H new ATOM 1502 N ASN A 161 7.849 0.211 0.842 1.00 0.00 N ATOM 1503 CA ASN A 161 7.354 -0.614 -0.247 1.00 0.00 C ATOM 1504 C ASN A 161 8.207 -1.829 -0.429 1.00 0.00 C ATOM 1505 O ASN A 161 7.727 -2.885 -0.843 1.00 0.00 O ATOM 1506 CB ASN A 161 7.200 0.159 -1.550 1.00 0.00 C ATOM 1507 CG ASN A 161 6.025 1.100 -1.499 1.00 0.00 C ATOM 1508 OD1 ASN A 161 6.149 2.267 -1.174 1.00 0.00 O ATOM 1509 ND2 ASN A 161 4.872 0.582 -1.789 1.00 0.00 N ATOM 0 H ASN A 161 8.549 0.901 0.570 1.00 0.00 H new ATOM 0 HA ASN A 161 6.353 -0.939 0.035 1.00 0.00 H new ATOM 0 HB2 ASN A 161 8.111 0.723 -1.749 1.00 0.00 H new ATOM 0 HB3 ASN A 161 7.072 -0.540 -2.376 1.00 0.00 H new ATOM 0 HD21 ASN A 161 4.030 1.157 -1.749 1.00 0.00 H new ATOM 0 HD22 ASN A 161 4.807 -0.400 -2.057 1.00 0.00 H new